3-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclohexan-1-amine

C13H18N4 — CID 63722980

IUPAC3-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclohexan-1-amine
SMILESCc1ccnc2nc(C3CCCC(N)C3)[nH]c12
InChIInChI=1S/C13H18N4/c1-8-5-6-15-13-11(8)16-12(17-13)9-3-2-4-10(14)7-9/h5-6,9-10H,2-4,7,14H2,1H3,(H,15,16,17)
InChIKeyLISFJPWFSNWOND-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.25
Rot. Bonds1

About 3-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclohexan-1-amine

3-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclohexan-1-amine (PubChem CID 63722980) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is 3-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclohexan-1-amine.

Molecular Properties

Compound Name3-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclohexan-1-amine
PubChem CID63722980
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC Name3-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclohexan-1-amine
SMILESCc1ccnc2nc(C3CCCC(N)C3)[nH]c12
InChIInChI=1S/C13H18N4/c1-8-5-6-15-13-11(8)16-12(17-13)9-3-2-4-10(14)7-9/h5-6,9-10H,2-4,7,14H2,1H3,(H,15,16,17)
InChIKeyLISFJPWFSNWOND-UHFFFAOYSA-N
XLogP2.25
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclohexan-1-amine?
The IUPAC name of 3-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclohexan-1-amine (CID 63722980) is 3-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclohexan-1-amine.
What is the SMILES notation for 3-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclohexan-1-amine?
The canonical SMILES for 3-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclohexan-1-amine is Cc1ccnc2nc(C3CCCC(N)C3)[nH]c12.
What is the InChIKey of 3-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclohexan-1-amine?
The InChIKey is LISFJPWFSNWOND-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-8-5-6-15-13-11(8)16-12(17-13)9-3-2-4-10(14)7-9/h5-6,9-10H,2-4,7,14H2,1H3,(H,15,16,17).
What are the key properties of 3-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclohexan-1-amine?
3-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclohexan-1-amine has a molecular weight of 230.31 g/mol, XLogP of 2.25, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)cyclohexan-1-amine is sourced from PubChem (CID 63722980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).