2-cyclopentyl-1-(1-methylcyclopentyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine

C17H27N3 — CID 64856837

IUPAC2-cyclopentyl-1-(1-methylcyclopentyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCC1(n2c(C3CCCC3)nc3c2CCNC3)CCCC1
InChIInChI=1S/C17H27N3/c1-17(9-4-5-10-17)20-15-8-11-18-12-14(15)19-16(20)13-6-2-3-7-13/h13,18H,2-12H2,1H3
InChIKeyYEJLWSXNBWXUSW-UHFFFAOYSA-N
MW273.42 g/mol
LogP3.48
Rot. Bonds2

About 2-cyclopentyl-1-(1-methylcyclopentyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine

2-cyclopentyl-1-(1-methylcyclopentyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (PubChem CID 64856837) has the molecular formula C17H27N3 and a molecular weight of 273.42 g/mol. Its IUPAC name is 2-cyclopentyl-1-(1-methylcyclopentyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name2-cyclopentyl-1-(1-methylcyclopentyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
PubChem CID64856837
Molecular FormulaC17H27N3
Molecular Weight273.42 g/mol
Exact Mass273.22
IUPAC Name2-cyclopentyl-1-(1-methylcyclopentyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCC1(n2c(C3CCCC3)nc3c2CCNC3)CCCC1
InChIInChI=1S/C17H27N3/c1-17(9-4-5-10-17)20-15-8-11-18-12-14(15)19-16(20)13-6-2-3-7-13/h13,18H,2-12H2,1H3
InChIKeyYEJLWSXNBWXUSW-UHFFFAOYSA-N
XLogP3.48
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-(1-methylcyclopentyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The IUPAC name of 2-cyclopentyl-1-(1-methylcyclopentyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (CID 64856837) is 2-cyclopentyl-1-(1-methylcyclopentyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.
What is the SMILES notation for 2-cyclopentyl-1-(1-methylcyclopentyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The canonical SMILES for 2-cyclopentyl-1-(1-methylcyclopentyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is CC1(n2c(C3CCCC3)nc3c2CCNC3)CCCC1.
What is the InChIKey of 2-cyclopentyl-1-(1-methylcyclopentyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The InChIKey is YEJLWSXNBWXUSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3/c1-17(9-4-5-10-17)20-15-8-11-18-12-14(15)19-16(20)13-6-2-3-7-13/h13,18H,2-12H2,1H3.
What are the key properties of 2-cyclopentyl-1-(1-methylcyclopentyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
2-cyclopentyl-1-(1-methylcyclopentyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine has a molecular weight of 273.42 g/mol, XLogP of 3.48, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-(1-methylcyclopentyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is sourced from PubChem (CID 64856837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).