N,N-dicyclopentyl-6-(1H-imidazo[4,5-c]pyridin-4-ylmethyl)pyridine-3-carboxamide

C23H27N5O — CID 54444182

IUPACN,N-dicyclopentyl-6-(1H-imidazo[4,5-c]pyridin-4-ylmethyl)pyridine-3-carboxamide
SMILESO=C(c1ccc(Cc2nccc3[nH]cnc23)nc1)N(C1CCCC1)C1CCCC1
InChIInChI=1S/C23H27N5O/c29-23(28(18-5-1-2-6-18)19-7-3-4-8-19)16-9-10-17(25-14-16)13-21-22-20(11-12-24-21)26-15-27-22/h9-12,14-15,18-19H,1-8,13H2,(H,26,27)
InChIKeyUNEUJXUTBGQUGZ-UHFFFAOYSA-N
MW389.50 g/mol
LogP4.27
Rot. Bonds5

About N,N-dicyclopentyl-6-(1H-imidazo[4,5-c]pyridin-4-ylmethyl)pyridine-3-carboxamide

N,N-dicyclopentyl-6-(1H-imidazo[4,5-c]pyridin-4-ylmethyl)pyridine-3-carboxamide (PubChem CID 54444182) has the molecular formula C23H27N5O and a molecular weight of 389.50 g/mol. Its IUPAC name is N,N-dicyclopentyl-6-(1H-imidazo[4,5-c]pyridin-4-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN,N-dicyclopentyl-6-(1H-imidazo[4,5-c]pyridin-4-ylmethyl)pyridine-3-carboxamide
PubChem CID54444182
Molecular FormulaC23H27N5O
Molecular Weight389.50 g/mol
Exact Mass389.22
IUPAC NameN,N-dicyclopentyl-6-(1H-imidazo[4,5-c]pyridin-4-ylmethyl)pyridine-3-carboxamide
SMILESO=C(c1ccc(Cc2nccc3[nH]cnc23)nc1)N(C1CCCC1)C1CCCC1
InChIInChI=1S/C23H27N5O/c29-23(28(18-5-1-2-6-18)19-7-3-4-8-19)16-9-10-17(25-14-16)13-21-22-20(11-12-24-21)26-15-27-22/h9-12,14-15,18-19H,1-8,13H2,(H,26,27)
InChIKeyUNEUJXUTBGQUGZ-UHFFFAOYSA-N
XLogP4.27
TPSA74.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.50
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dicyclopentyl-6-(1H-imidazo[4,5-c]pyridin-4-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of N,N-dicyclopentyl-6-(1H-imidazo[4,5-c]pyridin-4-ylmethyl)pyridine-3-carboxamide (CID 54444182) is N,N-dicyclopentyl-6-(1H-imidazo[4,5-c]pyridin-4-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for N,N-dicyclopentyl-6-(1H-imidazo[4,5-c]pyridin-4-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for N,N-dicyclopentyl-6-(1H-imidazo[4,5-c]pyridin-4-ylmethyl)pyridine-3-carboxamide is O=C(c1ccc(Cc2nccc3[nH]cnc23)nc1)N(C1CCCC1)C1CCCC1.
What is the InChIKey of N,N-dicyclopentyl-6-(1H-imidazo[4,5-c]pyridin-4-ylmethyl)pyridine-3-carboxamide?
The InChIKey is UNEUJXUTBGQUGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N5O/c29-23(28(18-5-1-2-6-18)19-7-3-4-8-19)16-9-10-17(25-14-16)13-21-22-20(11-12-24-21)26-15-27-22/h9-12,14-15,18-19H,1-8,13H2,(H,26,27).
What are the key properties of N,N-dicyclopentyl-6-(1H-imidazo[4,5-c]pyridin-4-ylmethyl)pyridine-3-carboxamide?
N,N-dicyclopentyl-6-(1H-imidazo[4,5-c]pyridin-4-ylmethyl)pyridine-3-carboxamide has a molecular weight of 389.50 g/mol, XLogP of 4.27, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dicyclopentyl-6-(1H-imidazo[4,5-c]pyridin-4-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 54444182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).