N-[[1-(aminomethyl)cyclohexyl]methyl]-1-methylimidazo[4,5-c]pyridin-4-amine

C15H23N5 — CID 103386537

IUPACN-[[1-(aminomethyl)cyclohexyl]methyl]-1-methylimidazo[4,5-c]pyridin-4-amine
SMILESCn1cnc2c(NCC3(CN)CCCCC3)nccc21
InChIInChI=1S/C15H23N5/c1-20-11-19-13-12(20)5-8-17-14(13)18-10-15(9-16)6-3-2-4-7-15/h5,8,11H,2-4,6-7,9-10,16H2,1H3,(H,17,18)
InChIKeyVMNAFYLCMSLFSW-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.29
Rot. Bonds4

About N-[[1-(aminomethyl)cyclohexyl]methyl]-1-methylimidazo[4,5-c]pyridin-4-amine

N-[[1-(aminomethyl)cyclohexyl]methyl]-1-methylimidazo[4,5-c]pyridin-4-amine (PubChem CID 103386537) has the molecular formula C15H23N5 and a molecular weight of 273.38 g/mol. Its IUPAC name is N-[[1-(aminomethyl)cyclohexyl]methyl]-1-methylimidazo[4,5-c]pyridin-4-amine.

Molecular Properties

Compound NameN-[[1-(aminomethyl)cyclohexyl]methyl]-1-methylimidazo[4,5-c]pyridin-4-amine
PubChem CID103386537
Molecular FormulaC15H23N5
Molecular Weight273.38 g/mol
Exact Mass273.20
IUPAC NameN-[[1-(aminomethyl)cyclohexyl]methyl]-1-methylimidazo[4,5-c]pyridin-4-amine
SMILESCn1cnc2c(NCC3(CN)CCCCC3)nccc21
InChIInChI=1S/C15H23N5/c1-20-11-19-13-12(20)5-8-17-14(13)18-10-15(9-16)6-3-2-4-7-15/h5,8,11H,2-4,6-7,9-10,16H2,1H3,(H,17,18)
InChIKeyVMNAFYLCMSLFSW-UHFFFAOYSA-N
XLogP2.29
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]methyl]cyclopentan-1-ol
CID 103385664
N-[1-(aminomethyl)cyclopentyl]-1-methylimidazo[4,5-c]pyridin-4-amine
CID 103386001
N-[[1-(aminomethyl)cyclobutyl]methyl]-1-methylbenzimidazol-5-amine
CID 115245633
N-(cyclopentylmethyl)-1-methylimidazo[4,5-c]pyridin-4-amine
CID 103385392
3-methyl-1-N-(1-methylimidazo[4,5-c]pyridin-4-yl)butane-1,2-diamine
CID 103386011
N-benzyl-1-methylimidazo[4,5-c]pyridin-4-amine
CID 1400630
N-(2-cyclopentyloxyethyl)-1-methylimidazo[4,5-c]pyridin-4-amine
CID 103385619
N-[[1-(aminomethyl)cyclohexyl]methyl]aniline
CID 115438130
1-methyl-N-(2-methylbutyl)imidazo[4,5-c]pyridin-4-amine
CID 103385588
N-(3-chloro-2,2-dimethylpropyl)-1-methylimidazo[4,5-c]pyridin-4-amine
CID 103386457
N-(2-chloroprop-2-enyl)-1-methylimidazo[4,5-c]pyridin-4-amine
CID 103385795
N-[[1-(aminomethyl)cyclohexyl]methyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-amine
CID 103970405

Frequently Asked Questions

What is the IUPAC name of N-[[1-(aminomethyl)cyclohexyl]methyl]-1-methylimidazo[4,5-c]pyridin-4-amine?
The IUPAC name of N-[[1-(aminomethyl)cyclohexyl]methyl]-1-methylimidazo[4,5-c]pyridin-4-amine (CID 103386537) is N-[[1-(aminomethyl)cyclohexyl]methyl]-1-methylimidazo[4,5-c]pyridin-4-amine.
What is the SMILES notation for N-[[1-(aminomethyl)cyclohexyl]methyl]-1-methylimidazo[4,5-c]pyridin-4-amine?
The canonical SMILES for N-[[1-(aminomethyl)cyclohexyl]methyl]-1-methylimidazo[4,5-c]pyridin-4-amine is Cn1cnc2c(NCC3(CN)CCCCC3)nccc21.
What is the InChIKey of N-[[1-(aminomethyl)cyclohexyl]methyl]-1-methylimidazo[4,5-c]pyridin-4-amine?
The InChIKey is VMNAFYLCMSLFSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5/c1-20-11-19-13-12(20)5-8-17-14(13)18-10-15(9-16)6-3-2-4-7-15/h5,8,11H,2-4,6-7,9-10,16H2,1H3,(H,17,18).
What are the key properties of N-[[1-(aminomethyl)cyclohexyl]methyl]-1-methylimidazo[4,5-c]pyridin-4-amine?
N-[[1-(aminomethyl)cyclohexyl]methyl]-1-methylimidazo[4,5-c]pyridin-4-amine has a molecular weight of 273.38 g/mol, XLogP of 2.29, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(aminomethyl)cyclohexyl]methyl]-1-methylimidazo[4,5-c]pyridin-4-amine is sourced from PubChem (CID 103386537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).