N-(cyclopentylmethyl)-1-methylimidazo[4,5-c]pyridin-4-amine

C13H18N4 — CID 103385392

IUPACN-(cyclopentylmethyl)-1-methylimidazo[4,5-c]pyridin-4-amine
SMILESCn1cnc2c(NCC3CCCC3)nccc21
InChIInChI=1S/C13H18N4/c1-17-9-16-12-11(17)6-7-14-13(12)15-8-10-4-2-3-5-10/h6-7,9-10H,2-5,8H2,1H3,(H,14,15)
InChIKeyNZPVVFLNUPDIIY-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.57
Rot. Bonds3

About N-(cyclopentylmethyl)-1-methylimidazo[4,5-c]pyridin-4-amine

N-(cyclopentylmethyl)-1-methylimidazo[4,5-c]pyridin-4-amine (PubChem CID 103385392) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-1-methylimidazo[4,5-c]pyridin-4-amine.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-1-methylimidazo[4,5-c]pyridin-4-amine
PubChem CID103385392
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC NameN-(cyclopentylmethyl)-1-methylimidazo[4,5-c]pyridin-4-amine
SMILESCn1cnc2c(NCC3CCCC3)nccc21
InChIInChI=1S/C13H18N4/c1-17-9-16-12-11(17)6-7-14-13(12)15-8-10-4-2-3-5-10/h6-7,9-10H,2-5,8H2,1H3,(H,14,15)
InChIKeyNZPVVFLNUPDIIY-UHFFFAOYSA-N
XLogP2.57
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-1-methylimidazo[4,5-c]pyridin-4-amine?
The IUPAC name of N-(cyclopentylmethyl)-1-methylimidazo[4,5-c]pyridin-4-amine (CID 103385392) is N-(cyclopentylmethyl)-1-methylimidazo[4,5-c]pyridin-4-amine.
What is the SMILES notation for N-(cyclopentylmethyl)-1-methylimidazo[4,5-c]pyridin-4-amine?
The canonical SMILES for N-(cyclopentylmethyl)-1-methylimidazo[4,5-c]pyridin-4-amine is Cn1cnc2c(NCC3CCCC3)nccc21.
What is the InChIKey of N-(cyclopentylmethyl)-1-methylimidazo[4,5-c]pyridin-4-amine?
The InChIKey is NZPVVFLNUPDIIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-17-9-16-12-11(17)6-7-14-13(12)15-8-10-4-2-3-5-10/h6-7,9-10H,2-5,8H2,1H3,(H,14,15).
What are the key properties of N-(cyclopentylmethyl)-1-methylimidazo[4,5-c]pyridin-4-amine?
N-(cyclopentylmethyl)-1-methylimidazo[4,5-c]pyridin-4-amine has a molecular weight of 230.31 g/mol, XLogP of 2.57, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-1-methylimidazo[4,5-c]pyridin-4-amine is sourced from PubChem (CID 103385392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).