[1-(1-methylimidazo[4,5-c]pyridin-2-yl)cycloheptyl]methanamine

C15H22N4 — CID 115443687

IUPAC[1-(1-methylimidazo[4,5-c]pyridin-2-yl)cycloheptyl]methanamine
SMILESCn1c(C2(CN)CCCCCC2)nc2cnccc21
InChIInChI=1S/C15H22N4/c1-19-13-6-9-17-10-12(13)18-14(19)15(11-16)7-4-2-3-5-8-15/h6,9-10H,2-5,7-8,11,16H2,1H3
InChIKeyXIZHWJKWAVKOON-UHFFFAOYSA-N
MW258.37 g/mol
LogP2.52
Rot. Bonds2

About [1-(1-methylimidazo[4,5-c]pyridin-2-yl)cycloheptyl]methanamine

[1-(1-methylimidazo[4,5-c]pyridin-2-yl)cycloheptyl]methanamine (PubChem CID 115443687) has the molecular formula C15H22N4 and a molecular weight of 258.37 g/mol. Its IUPAC name is [1-(1-methylimidazo[4,5-c]pyridin-2-yl)cycloheptyl]methanamine.

Molecular Properties

Compound Name[1-(1-methylimidazo[4,5-c]pyridin-2-yl)cycloheptyl]methanamine
PubChem CID115443687
Molecular FormulaC15H22N4
Molecular Weight258.37 g/mol
Exact Mass258.18
IUPAC Name[1-(1-methylimidazo[4,5-c]pyridin-2-yl)cycloheptyl]methanamine
SMILESCn1c(C2(CN)CCCCCC2)nc2cnccc21
InChIInChI=1S/C15H22N4/c1-19-13-6-9-17-10-12(13)18-14(19)15(11-16)7-4-2-3-5-8-15/h6,9-10H,2-5,7-8,11,16H2,1H3
InChIKeyXIZHWJKWAVKOON-UHFFFAOYSA-N
XLogP2.52
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-(1-methylimidazo[4,5-c]pyridin-2-yl)cycloheptyl]methanamine?
The IUPAC name of [1-(1-methylimidazo[4,5-c]pyridin-2-yl)cycloheptyl]methanamine (CID 115443687) is [1-(1-methylimidazo[4,5-c]pyridin-2-yl)cycloheptyl]methanamine.
What is the SMILES notation for [1-(1-methylimidazo[4,5-c]pyridin-2-yl)cycloheptyl]methanamine?
The canonical SMILES for [1-(1-methylimidazo[4,5-c]pyridin-2-yl)cycloheptyl]methanamine is Cn1c(C2(CN)CCCCCC2)nc2cnccc21.
What is the InChIKey of [1-(1-methylimidazo[4,5-c]pyridin-2-yl)cycloheptyl]methanamine?
The InChIKey is XIZHWJKWAVKOON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4/c1-19-13-6-9-17-10-12(13)18-14(19)15(11-16)7-4-2-3-5-8-15/h6,9-10H,2-5,7-8,11,16H2,1H3.
What are the key properties of [1-(1-methylimidazo[4,5-c]pyridin-2-yl)cycloheptyl]methanamine?
[1-(1-methylimidazo[4,5-c]pyridin-2-yl)cycloheptyl]methanamine has a molecular weight of 258.37 g/mol, XLogP of 2.52, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-methylimidazo[4,5-c]pyridin-2-yl)cycloheptyl]methanamine is sourced from PubChem (CID 115443687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).