N-(4-hydroxycyclohexyl)-5-(3-methylimidazo[1,5-a]pyrazin-1-yl)pyridine-2-carboxamide

C19H21N5O2 — CID 176790846

IUPACN-(4-hydroxycyclohexyl)-5-(3-methylimidazo[1,5-a]pyrazin-1-yl)pyridine-2-carboxamide
SMILESCc1nc(-c2ccc(C(=O)NC3CCC(O)CC3)nc2)c2cnccn12
InChIInChI=1S/C19H21N5O2/c1-12-22-18(17-11-20-8-9-24(12)17)13-2-7-16(21-10-13)19(26)23-14-3-5-15(25)6-4-14/h2,7-11,14-15,25H,3-6H2,1H3,(H,23,26)
InChIKeyHJLSFKBQNCQUGI-UHFFFAOYSA-N
MW351.41 g/mol
LogP2.13
Rot. Bonds3

About N-(4-hydroxycyclohexyl)-5-(3-methylimidazo[1,5-a]pyrazin-1-yl)pyridine-2-carboxamide

N-(4-hydroxycyclohexyl)-5-(3-methylimidazo[1,5-a]pyrazin-1-yl)pyridine-2-carboxamide (PubChem CID 176790846) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is N-(4-hydroxycyclohexyl)-5-(3-methylimidazo[1,5-a]pyrazin-1-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxycyclohexyl)-5-(3-methylimidazo[1,5-a]pyrazin-1-yl)pyridine-2-carboxamide
PubChem CID176790846
Molecular FormulaC19H21N5O2
Molecular Weight351.41 g/mol
Exact Mass351.17
IUPAC NameN-(4-hydroxycyclohexyl)-5-(3-methylimidazo[1,5-a]pyrazin-1-yl)pyridine-2-carboxamide
SMILESCc1nc(-c2ccc(C(=O)NC3CCC(O)CC3)nc2)c2cnccn12
InChIInChI=1S/C19H21N5O2/c1-12-22-18(17-11-20-8-9-24(12)17)13-2-7-16(21-10-13)19(26)23-14-3-5-15(25)6-4-14/h2,7-11,14-15,25H,3-6H2,1H3,(H,23,26)
InChIKeyHJLSFKBQNCQUGI-UHFFFAOYSA-N
XLogP2.13
TPSA92.41 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxycyclohexyl)-5-(3-methylimidazo[1,5-a]pyrazin-1-yl)pyridine-2-carboxamide?
The IUPAC name of N-(4-hydroxycyclohexyl)-5-(3-methylimidazo[1,5-a]pyrazin-1-yl)pyridine-2-carboxamide (CID 176790846) is N-(4-hydroxycyclohexyl)-5-(3-methylimidazo[1,5-a]pyrazin-1-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-(4-hydroxycyclohexyl)-5-(3-methylimidazo[1,5-a]pyrazin-1-yl)pyridine-2-carboxamide?
The canonical SMILES for N-(4-hydroxycyclohexyl)-5-(3-methylimidazo[1,5-a]pyrazin-1-yl)pyridine-2-carboxamide is Cc1nc(-c2ccc(C(=O)NC3CCC(O)CC3)nc2)c2cnccn12.
What is the InChIKey of N-(4-hydroxycyclohexyl)-5-(3-methylimidazo[1,5-a]pyrazin-1-yl)pyridine-2-carboxamide?
The InChIKey is HJLSFKBQNCQUGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O2/c1-12-22-18(17-11-20-8-9-24(12)17)13-2-7-16(21-10-13)19(26)23-14-3-5-15(25)6-4-14/h2,7-11,14-15,25H,3-6H2,1H3,(H,23,26).
What are the key properties of N-(4-hydroxycyclohexyl)-5-(3-methylimidazo[1,5-a]pyrazin-1-yl)pyridine-2-carboxamide?
N-(4-hydroxycyclohexyl)-5-(3-methylimidazo[1,5-a]pyrazin-1-yl)pyridine-2-carboxamide has a molecular weight of 351.41 g/mol, XLogP of 2.13, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxycyclohexyl)-5-(3-methylimidazo[1,5-a]pyrazin-1-yl)pyridine-2-carboxamide is sourced from PubChem (CID 176790846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).