N-[[4-(2,4-dimethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]-2-methylpropan-1-amine

C18H31N3 — CID 81253411

IUPACN-[[4-(2,4-dimethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]-2-methylpropan-1-amine
SMILESCc1cc(N2CCC(C)CC2C)c(CNCC(C)C)cn1
InChIInChI=1S/C18H31N3/c1-13(2)10-19-11-17-12-20-15(4)9-18(17)21-7-6-14(3)8-16(21)5/h9,12-14,16,19H,6-8,10-11H2,1-5H3
InChIKeyCNFYUSAERFVLRC-UHFFFAOYSA-N
MW289.47 g/mol
LogP3.76
Rot. Bonds5

About N-[[4-(2,4-dimethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]-2-methylpropan-1-amine

N-[[4-(2,4-dimethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]-2-methylpropan-1-amine (PubChem CID 81253411) has the molecular formula C18H31N3 and a molecular weight of 289.47 g/mol. Its IUPAC name is N-[[4-(2,4-dimethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]-2-methylpropan-1-amine.

Molecular Properties

Compound NameN-[[4-(2,4-dimethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]-2-methylpropan-1-amine
PubChem CID81253411
Molecular FormulaC18H31N3
Molecular Weight289.47 g/mol
Exact Mass289.25
IUPAC NameN-[[4-(2,4-dimethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]-2-methylpropan-1-amine
SMILESCc1cc(N2CCC(C)CC2C)c(CNCC(C)C)cn1
InChIInChI=1S/C18H31N3/c1-13(2)10-19-11-17-12-20-15(4)9-18(17)21-7-6-14(3)8-16(21)5/h9,12-14,16,19H,6-8,10-11H2,1-5H3
InChIKeyCNFYUSAERFVLRC-UHFFFAOYSA-N
XLogP3.76
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.47
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[4-(2,4-dimethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]-2-methylpropan-1-amine with MolForge

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Related Compounds

2-methyl-N-[[6-methyl-4-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methyl]propan-1-amine
CID 81246198
N-[[4-(2,4-dimethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]cyclopropanamine
CID 81247350
2-methyl-N-[[6-methyl-4-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)-3-pyridinyl]methyl]propan-1-amine
CID 114412754
N-[[6-methyl-4-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine
CID 81249357
N-[[4-(2,5-dimethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]propan-1-amine
CID 81247735
N-[[6-methyl-4-(4-propan-2-ylpiperidin-1-yl)-3-pyridinyl]methyl]ethanamine
CID 103502997
N-methyl-1-[6-methyl-4-(3-methylpyrrolidin-1-yl)-3-pyridinyl]methanamine
CID 81246576
N-[[4-(2-ethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]propan-2-amine
CID 81248517
N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-amine
CID 81254130
N-[[4-chloro-2-(2,4-dimethylpiperidin-1-yl)phenyl]methyl]ethanamine
CID 114850627
N-[[2-(2,4-dimethylpiperidin-1-yl)-5-fluorophenyl]methyl]ethanamine
CID 62332170
N-[[4-bromo-2-(2,4-dimethylpiperidin-1-yl)phenyl]methyl]propan-1-amine
CID 63551604

Frequently Asked Questions

What is the IUPAC name of N-[[4-(2,4-dimethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]-2-methylpropan-1-amine?
The IUPAC name of N-[[4-(2,4-dimethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]-2-methylpropan-1-amine (CID 81253411) is N-[[4-(2,4-dimethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]-2-methylpropan-1-amine.
What is the SMILES notation for N-[[4-(2,4-dimethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]-2-methylpropan-1-amine?
The canonical SMILES for N-[[4-(2,4-dimethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]-2-methylpropan-1-amine is Cc1cc(N2CCC(C)CC2C)c(CNCC(C)C)cn1.
What is the InChIKey of N-[[4-(2,4-dimethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]-2-methylpropan-1-amine?
The InChIKey is CNFYUSAERFVLRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H31N3/c1-13(2)10-19-11-17-12-20-15(4)9-18(17)21-7-6-14(3)8-16(21)5/h9,12-14,16,19H,6-8,10-11H2,1-5H3.
What are the key properties of N-[[4-(2,4-dimethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]-2-methylpropan-1-amine?
N-[[4-(2,4-dimethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]-2-methylpropan-1-amine has a molecular weight of 289.47 g/mol, XLogP of 3.76, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(2,4-dimethylpiperidin-1-yl)-6-methyl-3-pyridinyl]methyl]-2-methylpropan-1-amine is sourced from PubChem (CID 81253411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).