N-cyclohexyl-1-(3-cyclopropylimidazo[1,5-a]pyridine-1-carbonyl)pyrrolidine-2-carboxamide

C22H28N4O2 — CID 110625664

IUPACN-cyclohexyl-1-(3-cyclopropylimidazo[1,5-a]pyridine-1-carbonyl)pyrrolidine-2-carboxamide
SMILESO=C(NC1CCCCC1)C1CCCN1C(=O)c1nc(C2CC2)n2ccccc12
InChIInChI=1S/C22H28N4O2/c27-21(23-16-7-2-1-3-8-16)18-10-6-14-26(18)22(28)19-17-9-4-5-13-25(17)20(24-19)15-11-12-15/h4-5,9,13,15-16,18H,1-3,6-8,10-12,14H2,(H,23,27)
InChIKeyNHFGIXXJPWRWPW-UHFFFAOYSA-N
MW380.49 g/mol
LogP3.27
Rot. Bonds4

About N-cyclohexyl-1-(3-cyclopropylimidazo[1,5-a]pyridine-1-carbonyl)pyrrolidine-2-carboxamide

N-cyclohexyl-1-(3-cyclopropylimidazo[1,5-a]pyridine-1-carbonyl)pyrrolidine-2-carboxamide (PubChem CID 110625664) has the molecular formula C22H28N4O2 and a molecular weight of 380.49 g/mol. Its IUPAC name is N-cyclohexyl-1-(3-cyclopropylimidazo[1,5-a]pyridine-1-carbonyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-1-(3-cyclopropylimidazo[1,5-a]pyridine-1-carbonyl)pyrrolidine-2-carboxamide
PubChem CID110625664
Molecular FormulaC22H28N4O2
Molecular Weight380.49 g/mol
Exact Mass380.22
IUPAC NameN-cyclohexyl-1-(3-cyclopropylimidazo[1,5-a]pyridine-1-carbonyl)pyrrolidine-2-carboxamide
SMILESO=C(NC1CCCCC1)C1CCCN1C(=O)c1nc(C2CC2)n2ccccc12
InChIInChI=1S/C22H28N4O2/c27-21(23-16-7-2-1-3-8-16)18-10-6-14-26(18)22(28)19-17-9-4-5-13-25(17)20(24-19)15-11-12-15/h4-5,9,13,15-16,18H,1-3,6-8,10-12,14H2,(H,23,27)
InChIKeyNHFGIXXJPWRWPW-UHFFFAOYSA-N
XLogP3.27
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.49
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1-(3-cyclopropylimidazo[1,5-a]pyridine-1-carbonyl)pyrrolidine-2-carboxamide?
The IUPAC name of N-cyclohexyl-1-(3-cyclopropylimidazo[1,5-a]pyridine-1-carbonyl)pyrrolidine-2-carboxamide (CID 110625664) is N-cyclohexyl-1-(3-cyclopropylimidazo[1,5-a]pyridine-1-carbonyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for N-cyclohexyl-1-(3-cyclopropylimidazo[1,5-a]pyridine-1-carbonyl)pyrrolidine-2-carboxamide?
The canonical SMILES for N-cyclohexyl-1-(3-cyclopropylimidazo[1,5-a]pyridine-1-carbonyl)pyrrolidine-2-carboxamide is O=C(NC1CCCCC1)C1CCCN1C(=O)c1nc(C2CC2)n2ccccc12.
What is the InChIKey of N-cyclohexyl-1-(3-cyclopropylimidazo[1,5-a]pyridine-1-carbonyl)pyrrolidine-2-carboxamide?
The InChIKey is NHFGIXXJPWRWPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N4O2/c27-21(23-16-7-2-1-3-8-16)18-10-6-14-26(18)22(28)19-17-9-4-5-13-25(17)20(24-19)15-11-12-15/h4-5,9,13,15-16,18H,1-3,6-8,10-12,14H2,(H,23,27).
What are the key properties of N-cyclohexyl-1-(3-cyclopropylimidazo[1,5-a]pyridine-1-carbonyl)pyrrolidine-2-carboxamide?
N-cyclohexyl-1-(3-cyclopropylimidazo[1,5-a]pyridine-1-carbonyl)pyrrolidine-2-carboxamide has a molecular weight of 380.49 g/mol, XLogP of 3.27, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1-(3-cyclopropylimidazo[1,5-a]pyridine-1-carbonyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 110625664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).