5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-2-(1-pyrrolidin-1-ylethyl)pyridine;N-cyclohexyl-N-methyl-5-propan-2-ylpyridin-2-amine;N-cyclopentyl-5-propan-2-ylpyridin-2-amine;N-methyl-N-(1-methylpyrrolidin-3-yl)-5-propan-2-ylpyridin-2-amine;2-[methyl-(5-propan-2-yl-2-pyridinyl)amino]ethanol;2-(1-piperidin-1-ylethyl)-5-propan-2-ylpyridine;N,N,N'-trimethyl-N'-(5-propan-2-yl-2-pyridinyl)ethane-1,2-diamine

C107H174N18O — CID 162171657

IUPAC5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-2-(1-pyrrolidin-1-ylethyl)pyridine;N-cyclohexyl-N-methyl-5-propan-2-ylpyridin-2-amine;N-cyclopentyl-5-propan-2-ylpyridin-2-amine;N-methyl-N-(1-methylpyrrolidin-3-yl)-5-propan-2-ylpyridin-2-amine;2-[methyl-(5-propan-2-yl-2-pyridinyl)amino]ethanol;2-(1-piperidin-1-ylethyl)-5-propan-2-ylpyridine;N,N,N'-trimethyl-N'-(5-propan-2-yl-2-pyridinyl)ethane-1,2-diamine
SMILESCC(C)c1ccc(C(C)N2CCCCC2)nc1.CC(C)c1ccc(N(C)C2CCCCC2)nc1.CC(C)c1ccc(N(C)C2CCN(C)C2)nc1.CC(C)c1ccc(N(C)CCN(C)C)nc1.CC(C)c1ccc(N(C)CCO)nc1.CC(C)c1ccc(NC2CCCC2)nc1.CC(c1ccc(C(C)(C)C)cn1)N1CCCC1.CN(C)c1ccc(C(C)(C)C)cn1
InChIInChI=1S/3C15H24N2.C14H23N3.C13H23N3.C13H20N2.C11H18N2O.C11H18N2/c1-12(17-9-5-6-10-17)14-8-7-13(11-16-14)15(2,3)4;1-12(2)14-7-8-15(16-11-14)13(3)17-9-5-4-6-10-17;1-12(2)13-9-10-15(16-11-13)17(3)14-7-5-4-6-8-14;1-11(2)12-5-6-14(15-9-12)17(4)13-7-8-16(3)10-13;1-11(2)12-6-7-13(14-10-12)16(5)9-8-15(3)4;1-10(2)11-7-8-13(14-9-11)15-12-5-3-4-6-12;1-9(2)10-4-5-11(12-8-10)13(3)6-7-14;1-11(2,3)9-6-7-10(12-8-9)13(4)5/h7-8,11-12H,5-6,9-10H2,1-4H3;7-8,11-13H,4-6,9-10H2,1-3H3;9-12,14H,4-8H2,1-3H3;5-6,9,11,13H,7-8,10H2,1-4H3;6-7,10-11H,8-9H2,1-5H3;7-10,12H,3-6H2,1-2H3,(H,14,15);4-5,8-9,14H,6-7H2,1-3H3;6-8H,1-5H3
InChIKeyZNWJUVVERCPNSD-UHFFFAOYSA-N
MW1728.69 g/mol
LogP23.45
Rot. Bonds24

About 5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-2-(1-pyrrolidin-1-ylethyl)pyridine;N-cyclohexyl-N-methyl-5-propan-2-ylpyridin-2-amine;N-cyclopentyl-5-propan-2-ylpyridin-2-amine;N-methyl-N-(1-methylpyrrolidin-3-yl)-5-propan-2-ylpyridin-2-amine;2-[methyl-(5-propan-2-yl-2-pyridinyl)amino]ethanol;2-(1-piperidin-1-ylethyl)-5-propan-2-ylpyridine;N,N,N'-trimethyl-N'-(5-propan-2-yl-2-pyridinyl)ethane-1,2-diamine

5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-2-(1-pyrrolidin-1-ylethyl)pyridine;N-cyclohexyl-N-methyl-5-propan-2-ylpyridin-2-amine;N-cyclopentyl-5-propan-2-ylpyridin-2-amine;N-methyl-N-(1-methylpyrrolidin-3-yl)-5-propan-2-ylpyridin-2-amine;2-[methyl-(5-propan-2-yl-2-pyridinyl)amino]ethanol;2-(1-piperidin-1-ylethyl)-5-propan-2-ylpyridine;N,N,N'-trimethyl-N'-(5-propan-2-yl-2-pyridinyl)ethane-1,2-diamine (PubChem CID 162171657) has the molecular formula C107H174N18O and a molecular weight of 1728.69 g/mol. Its IUPAC name is 5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-2-(1-pyrrolidin-1-ylethyl)pyridine;N-cyclohexyl-N-methyl-5-propan-2-ylpyridin-2-amine;N-cyclopentyl-5-propan-2-ylpyridin-2-amine;N-methyl-N-(1-methylpyrrolidin-3-yl)-5-propan-2-ylpyridin-2-amine;2-[methyl-(5-propan-2-yl-2-pyridinyl)amino]ethanol;2-(1-piperidin-1-ylethyl)-5-propan-2-ylpyridine;N,N,N'-trimethyl-N'-(5-propan-2-yl-2-pyridinyl)ethane-1,2-diamine.

Molecular Properties

Compound Name5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-2-(1-pyrrolidin-1-ylethyl)pyridine;N-cyclohexyl-N-methyl-5-propan-2-ylpyridin-2-amine;N-cyclopentyl-5-propan-2-ylpyridin-2-amine;N-methyl-N-(1-methylpyrrolidin-3-yl)-5-propan-2-ylpyridin-2-amine;2-[methyl-(5-propan-2-yl-2-pyridinyl)amino]ethanol;2-(1-piperidin-1-ylethyl)-5-propan-2-ylpyridine;N,N,N'-trimethyl-N'-(5-propan-2-yl-2-pyridinyl)ethane-1,2-diamine
PubChem CID162171657
Molecular FormulaC107H174N18O
Molecular Weight1728.69 g/mol
Exact Mass1727.41
IUPAC Name5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-2-(1-pyrrolidin-1-ylethyl)pyridine;N-cyclohexyl-N-methyl-5-propan-2-ylpyridin-2-amine;N-cyclopentyl-5-propan-2-ylpyridin-2-amine;N-methyl-N-(1-methylpyrrolidin-3-yl)-5-propan-2-ylpyridin-2-amine;2-[methyl-(5-propan-2-yl-2-pyridinyl)amino]ethanol;2-(1-piperidin-1-ylethyl)-5-propan-2-ylpyridine;N,N,N'-trimethyl-N'-(5-propan-2-yl-2-pyridinyl)ethane-1,2-diamine
SMILESCC(C)c1ccc(C(C)N2CCCCC2)nc1.CC(C)c1ccc(N(C)C2CCCCC2)nc1.CC(C)c1ccc(N(C)C2CCN(C)C2)nc1.CC(C)c1ccc(N(C)CCN(C)C)nc1.CC(C)c1ccc(N(C)CCO)nc1.CC(C)c1ccc(NC2CCCC2)nc1.CC(c1ccc(C(C)(C)C)cn1)N1CCCC1.CN(C)c1ccc(C(C)(C)C)cn1
InChIInChI=1S/3C15H24N2.C14H23N3.C13H23N3.C13H20N2.C11H18N2O.C11H18N2/c1-12(17-9-5-6-10-17)14-8-7-13(11-16-14)15(2,3)4;1-12(2)14-7-8-15(16-11-14)13(3)17-9-5-4-6-10-17;1-12(2)13-9-10-15(16-11-13)17(3)14-7-5-4-6-8-14;1-11(2)12-5-6-14(15-9-12)17(4)13-7-8-16(3)10-13;1-11(2)12-6-7-13(14-10-12)16(5)9-8-15(3)4;1-10(2)11-7-8-13(14-9-11)15-12-5-3-4-6-12;1-9(2)10-4-5-11(12-8-10)13(3)6-7-14;1-11(2,3)9-6-7-10(12-8-9)13(4)5/h7-8,11-12H,5-6,9-10H2,1-4H3;7-8,11-13H,4-6,9-10H2,1-3H3;9-12,14H,4-8H2,1-3H3;5-6,9,11,13H,7-8,10H2,1-4H3;6-7,10-11H,8-9H2,1-5H3;7-10,12H,3-6H2,1-2H3,(H,14,15);4-5,8-9,14H,6-7H2,1-3H3;6-8H,1-5H3
InChIKeyZNWJUVVERCPNSD-UHFFFAOYSA-N
XLogP23.45
TPSA164.54 Ų
H-Bond Donors2
H-Bond Acceptors19
Rotatable Bonds24
Heavy Atoms126
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001728.69
LogP ≤ 523.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1019

Analyze 5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-2-(1-pyrrolidin-1-ylethyl)pyridine;N-cyclohexyl-N-methyl-5-propan-2-ylpyridin-2-amine;N-cyclopentyl-5-propan-2-ylpyridin-2-amine;N-methyl-N-(1-methylpyrrolidin-3-yl)-5-propan-2-ylpyridin-2-amine;2-[methyl-(5-propan-2-yl-2-pyridinyl)amino]ethanol;2-(1-piperidin-1-ylethyl)-5-propan-2-ylpyridine;N,N,N'-trimethyl-N'-(5-propan-2-yl-2-pyridinyl)ethane-1,2-diamine with MolForge

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Launch Full Analysis

Related Compounds

US10906905, Example 18-1
CID 134439579
US10906905, Example 5
CID 134439727
US10906905, Example 5-1
CID 134439728
2-[[4-[4-(6-Methyl-2-pyridinyl)-5-aza-2-azoniatricyclo[5.2.2.02,6]undeca-2,4-dien-3-yl]-2-pyridinyl]amino]ethanol
CID 147486371
2-(3,3-difluoropyrrolidin-1-yl)-N-[6-[[1-[4-(1-methylpiperidin-4-yl)-6-[[4-(trifluoromethyl)-2-pyridinyl]amino]pyrimidin-2-yl]pyrrolidin-2-yl]methyl]-4-propan-2-yl-2-pyridinyl]-6-piperidin-4-ylpyrimidin-4-amine
CID 123719409
2-[4-[6-[6-[2-[(Z)-3-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]-3-iminoprop-1-enyl]-1H-imidazol-5-yl]-2-pyridinyl]-2-pyridinyl]piperazin-1-yl]ethanol
CID 135998188
2-[4-[4-[6-[2-[(Z)-3-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]-3-iminoprop-1-enyl]-1H-imidazol-5-yl]-2-pyridinyl]-2-pyridinyl]piperazin-1-yl]ethanol
CID 135998206
2-[4-[4-[6-[2-[3-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]-3-iminoprop-1-enyl]-1H-imidazol-5-yl]-2-pyridinyl]-2-pyridinyl]piperazin-1-yl]ethanol
CID 137124222
2-[4-[6-[6-[2-[3-[(2R)-2-(3-fluorophenyl)pyrrolidin-1-yl]-3-iminoprop-1-enyl]-1H-imidazol-5-yl]-2-pyridinyl]-2-pyridinyl]piperazin-1-yl]ethanol
CID 137156245
4-[(2R)-2-tert-butylpyrrolidin-1-yl]-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-amine;4-[4-methyl-4-(trifluoromethyl)piperidin-1-yl]-N-[2-(trifluoromethyl)-4-pyridinyl]-6-[6-(trifluoromethyl)-2-pyridinyl]-1,3,5-triazin-2-amine;(3S,4R)-4-methyl-1-[4-[6-(trifluoromethyl)-2-pyridinyl]-6-[[2-(trifluoromethyl)-4-pyridinyl]amino]-1,3,5-triazin-2-yl]pyrrolidin-3-ol
CID 160223858
5-tert-butyl-2-(4,4-difluoropiperidin-1-yl)pyridine;5-tert-butyl-2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyridine;5-tert-butyl-2-piperidin-1-ylpyridine;1-(5-tert-butyl-2-pyridinyl)-4-ethylpiperazine;bis(1-(5-tert-butyl-2-pyridinyl)-4-methylpiperazine);4-(5-tert-butyl-2-pyridinyl)morpholine;1-(5-tert-butyl-2-pyridinyl)piperazine;1-(5-tert-butyl-2-pyridinyl)piperidin-4-ol
CID 167609409
5-tert-butyl-N-cyclohexylpyridin-2-amine;5-tert-butyl-2-(4,4-difluoropiperidin-1-yl)pyridine;5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-2-(1-methylpiperidin-4-yl)pyridine;5-tert-butyl-2-phenylpyridine;5-tert-butyl-2-piperidin-1-ylpyridine;5-tert-butylpyridin-2-amine;N-(5-tert-butyl-2-pyridinyl)-N',N'-dimethylethane-1,2-diamine;N-(5-tert-butyl-2-pyridinyl)methanesulfonamide;1-(5-tert-butyl-2-pyridinyl)piperidin-4-ol;5-tert-butyl-2-(trifluoromethyl)pyridine
CID 167690914

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-2-(1-pyrrolidin-1-ylethyl)pyridine;N-cyclohexyl-N-methyl-5-propan-2-ylpyridin-2-amine;N-cyclopentyl-5-propan-2-ylpyridin-2-amine;N-methyl-N-(1-methylpyrrolidin-3-yl)-5-propan-2-ylpyridin-2-amine;2-[methyl-(5-propan-2-yl-2-pyridinyl)amino]ethanol;2-(1-piperidin-1-ylethyl)-5-propan-2-ylpyridine;N,N,N'-trimethyl-N'-(5-propan-2-yl-2-pyridinyl)ethane-1,2-diamine?
The IUPAC name of 5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-2-(1-pyrrolidin-1-ylethyl)pyridine;N-cyclohexyl-N-methyl-5-propan-2-ylpyridin-2-amine;N-cyclopentyl-5-propan-2-ylpyridin-2-amine;N-methyl-N-(1-methylpyrrolidin-3-yl)-5-propan-2-ylpyridin-2-amine;2-[methyl-(5-propan-2-yl-2-pyridinyl)amino]ethanol;2-(1-piperidin-1-ylethyl)-5-propan-2-ylpyridine;N,N,N'-trimethyl-N'-(5-propan-2-yl-2-pyridinyl)ethane-1,2-diamine (CID 162171657) is 5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-2-(1-pyrrolidin-1-ylethyl)pyridine;N-cyclohexyl-N-methyl-5-propan-2-ylpyridin-2-amine;N-cyclopentyl-5-propan-2-ylpyridin-2-amine;N-methyl-N-(1-methylpyrrolidin-3-yl)-5-propan-2-ylpyridin-2-amine;2-[methyl-(5-propan-2-yl-2-pyridinyl)amino]ethanol;2-(1-piperidin-1-ylethyl)-5-propan-2-ylpyridine;N,N,N'-trimethyl-N'-(5-propan-2-yl-2-pyridinyl)ethane-1,2-diamine.
What is the SMILES notation for 5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-2-(1-pyrrolidin-1-ylethyl)pyridine;N-cyclohexyl-N-methyl-5-propan-2-ylpyridin-2-amine;N-cyclopentyl-5-propan-2-ylpyridin-2-amine;N-methyl-N-(1-methylpyrrolidin-3-yl)-5-propan-2-ylpyridin-2-amine;2-[methyl-(5-propan-2-yl-2-pyridinyl)amino]ethanol;2-(1-piperidin-1-ylethyl)-5-propan-2-ylpyridine;N,N,N'-trimethyl-N'-(5-propan-2-yl-2-pyridinyl)ethane-1,2-diamine?
The canonical SMILES for 5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-2-(1-pyrrolidin-1-ylethyl)pyridine;N-cyclohexyl-N-methyl-5-propan-2-ylpyridin-2-amine;N-cyclopentyl-5-propan-2-ylpyridin-2-amine;N-methyl-N-(1-methylpyrrolidin-3-yl)-5-propan-2-ylpyridin-2-amine;2-[methyl-(5-propan-2-yl-2-pyridinyl)amino]ethanol;2-(1-piperidin-1-ylethyl)-5-propan-2-ylpyridine;N,N,N'-trimethyl-N'-(5-propan-2-yl-2-pyridinyl)ethane-1,2-diamine is CC(C)c1ccc(C(C)N2CCCCC2)nc1.CC(C)c1ccc(N(C)C2CCCCC2)nc1.CC(C)c1ccc(N(C)C2CCN(C)C2)nc1.CC(C)c1ccc(N(C)CCN(C)C)nc1.CC(C)c1ccc(N(C)CCO)nc1.CC(C)c1ccc(NC2CCCC2)nc1.CC(c1ccc(C(C)(C)C)cn1)N1CCCC1.CN(C)c1ccc(C(C)(C)C)cn1.
What is the InChIKey of 5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-2-(1-pyrrolidin-1-ylethyl)pyridine;N-cyclohexyl-N-methyl-5-propan-2-ylpyridin-2-amine;N-cyclopentyl-5-propan-2-ylpyridin-2-amine;N-methyl-N-(1-methylpyrrolidin-3-yl)-5-propan-2-ylpyridin-2-amine;2-[methyl-(5-propan-2-yl-2-pyridinyl)amino]ethanol;2-(1-piperidin-1-ylethyl)-5-propan-2-ylpyridine;N,N,N'-trimethyl-N'-(5-propan-2-yl-2-pyridinyl)ethane-1,2-diamine?
The InChIKey is ZNWJUVVERCPNSD-UHFFFAOYSA-N. The full InChI is InChI=1S/3C15H24N2.C14H23N3.C13H23N3.C13H20N2.C11H18N2O.C11H18N2/c1-12(17-9-5-6-10-17)14-8-7-13(11-16-14)15(2,3)4;1-12(2)14-7-8-15(16-11-14)13(3)17-9-5-4-6-10-17;1-12(2)13-9-10-15(16-11-13)17(3)14-7-5-4-6-8-14;1-11(2)12-5-6-14(15-9-12)17(4)13-7-8-16(3)10-13;1-11(2)12-6-7-13(14-10-12)16(5)9-8-15(3)4;1-10(2)11-7-8-13(14-9-11)15-12-5-3-4-6-12;1-9(2)10-4-5-11(12-8-10)13(3)6-7-14;1-11(2,3)9-6-7-10(12-8-9)13(4)5/h7-8,11-12H,5-6,9-10H2,1-4H3;7-8,11-13H,4-6,9-10H2,1-3H3;9-12,14H,4-8H2,1-3H3;5-6,9,11,13H,7-8,10H2,1-4H3;6-7,10-11H,8-9H2,1-5H3;7-10,12H,3-6H2,1-2H3,(H,14,15);4-5,8-9,14H,6-7H2,1-3H3;6-8H,1-5H3.
What are the key properties of 5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-2-(1-pyrrolidin-1-ylethyl)pyridine;N-cyclohexyl-N-methyl-5-propan-2-ylpyridin-2-amine;N-cyclopentyl-5-propan-2-ylpyridin-2-amine;N-methyl-N-(1-methylpyrrolidin-3-yl)-5-propan-2-ylpyridin-2-amine;2-[methyl-(5-propan-2-yl-2-pyridinyl)amino]ethanol;2-(1-piperidin-1-ylethyl)-5-propan-2-ylpyridine;N,N,N'-trimethyl-N'-(5-propan-2-yl-2-pyridinyl)ethane-1,2-diamine?
5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-2-(1-pyrrolidin-1-ylethyl)pyridine;N-cyclohexyl-N-methyl-5-propan-2-ylpyridin-2-amine;N-cyclopentyl-5-propan-2-ylpyridin-2-amine;N-methyl-N-(1-methylpyrrolidin-3-yl)-5-propan-2-ylpyridin-2-amine;2-[methyl-(5-propan-2-yl-2-pyridinyl)amino]ethanol;2-(1-piperidin-1-ylethyl)-5-propan-2-ylpyridine;N,N,N'-trimethyl-N'-(5-propan-2-yl-2-pyridinyl)ethane-1,2-diamine has a molecular weight of 1728.69 g/mol, XLogP of 23.45, 24 rotatable bonds, 2 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-N,N-dimethylpyridin-2-amine;5-tert-butyl-2-(1-pyrrolidin-1-ylethyl)pyridine;N-cyclohexyl-N-methyl-5-propan-2-ylpyridin-2-amine;N-cyclopentyl-5-propan-2-ylpyridin-2-amine;N-methyl-N-(1-methylpyrrolidin-3-yl)-5-propan-2-ylpyridin-2-amine;2-[methyl-(5-propan-2-yl-2-pyridinyl)amino]ethanol;2-(1-piperidin-1-ylethyl)-5-propan-2-ylpyridine;N,N,N'-trimethyl-N'-(5-propan-2-yl-2-pyridinyl)ethane-1,2-diamine is sourced from PubChem (CID 162171657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).