2-[[methyl-[(2-methylcyclopropyl)methyl]amino]methyl]-N-propylpyridin-4-amine

C15H25N3 — CID 79251024

IUPAC2-[[methyl-[(2-methylcyclopropyl)methyl]amino]methyl]-N-propylpyridin-4-amine
SMILESCCCNc1ccnc(CN(C)CC2CC2C)c1
InChIInChI=1S/C15H25N3/c1-4-6-16-14-5-7-17-15(9-14)11-18(3)10-13-8-12(13)2/h5,7,9,12-13H,4,6,8,10-11H2,1-3H3,(H,16,17)
InChIKeyMMACNCQUBXXZQM-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.99
Rot. Bonds7

About 2-[[methyl-[(2-methylcyclopropyl)methyl]amino]methyl]-N-propylpyridin-4-amine

2-[[methyl-[(2-methylcyclopropyl)methyl]amino]methyl]-N-propylpyridin-4-amine (PubChem CID 79251024) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 2-[[methyl-[(2-methylcyclopropyl)methyl]amino]methyl]-N-propylpyridin-4-amine.

Molecular Properties

Compound Name2-[[methyl-[(2-methylcyclopropyl)methyl]amino]methyl]-N-propylpyridin-4-amine
PubChem CID79251024
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name2-[[methyl-[(2-methylcyclopropyl)methyl]amino]methyl]-N-propylpyridin-4-amine
SMILESCCCNc1ccnc(CN(C)CC2CC2C)c1
InChIInChI=1S/C15H25N3/c1-4-6-16-14-5-7-17-15(9-14)11-18(3)10-13-8-12(13)2/h5,7,9,12-13H,4,6,8,10-11H2,1-3H3,(H,16,17)
InChIKeyMMACNCQUBXXZQM-UHFFFAOYSA-N
XLogP2.99
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N,N'-trimethyl-N'-[[4-(propylamino)-2-pyridinyl]methyl]ethane-1,2-diamine
CID 79250847
2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]-N-propylpyridin-4-amine
CID 79313466
2-[methyl-[[4-(propylamino)-2-pyridinyl]methyl]amino]ethanol
CID 79244315
2-[[3-methoxypropyl(methyl)amino]methyl]-N-propylpyridin-4-amine
CID 79251101
2-[(3,4-dimethylcyclohexyl)oxymethyl]-N-propylpyridin-4-amine
CID 79259878
2-[cyanomethyl-[[4-(propylamino)-2-pyridinyl]methyl]amino]acetonitrile
CID 79245643
2-[[butyl(ethyl)amino]methyl]-N-propylpyridin-4-amine
CID 79244631
N,N-dimethyl-N'-(2-methylpropyl)-N'-[[4-(propylamino)-2-pyridinyl]methyl]ethane-1,2-diamine
CID 79245192
N-ethyl-2-[[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]methyl]pyridin-4-amine
CID 79313465
2-[[ethyl(2-methoxyethyl)amino]methyl]-N-propylpyridin-4-amine
CID 79245356
2-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]-N-propylpyridin-4-amine
CID 79245841
2-[[2,2-difluoroethyl(methyl)amino]methyl]-N-ethylpyridin-4-amine
CID 115883847

Frequently Asked Questions

What is the IUPAC name of 2-[[methyl-[(2-methylcyclopropyl)methyl]amino]methyl]-N-propylpyridin-4-amine?
The IUPAC name of 2-[[methyl-[(2-methylcyclopropyl)methyl]amino]methyl]-N-propylpyridin-4-amine (CID 79251024) is 2-[[methyl-[(2-methylcyclopropyl)methyl]amino]methyl]-N-propylpyridin-4-amine.
What is the SMILES notation for 2-[[methyl-[(2-methylcyclopropyl)methyl]amino]methyl]-N-propylpyridin-4-amine?
The canonical SMILES for 2-[[methyl-[(2-methylcyclopropyl)methyl]amino]methyl]-N-propylpyridin-4-amine is CCCNc1ccnc(CN(C)CC2CC2C)c1.
What is the InChIKey of 2-[[methyl-[(2-methylcyclopropyl)methyl]amino]methyl]-N-propylpyridin-4-amine?
The InChIKey is MMACNCQUBXXZQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-4-6-16-14-5-7-17-15(9-14)11-18(3)10-13-8-12(13)2/h5,7,9,12-13H,4,6,8,10-11H2,1-3H3,(H,16,17).
What are the key properties of 2-[[methyl-[(2-methylcyclopropyl)methyl]amino]methyl]-N-propylpyridin-4-amine?
2-[[methyl-[(2-methylcyclopropyl)methyl]amino]methyl]-N-propylpyridin-4-amine has a molecular weight of 247.39 g/mol, XLogP of 2.99, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[methyl-[(2-methylcyclopropyl)methyl]amino]methyl]-N-propylpyridin-4-amine is sourced from PubChem (CID 79251024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).