N-(1-cyclohexylethyl)-5-hydroxy-2-(6-methoxy-2-pyridinyl)-6-oxo-1H-pyrimidine-4-carboxamide

C19H24N4O4 — CID 137297015

IUPACN-(1-cyclohexylethyl)-5-hydroxy-2-(6-methoxy-2-pyridinyl)-6-oxo-1H-pyrimidine-4-carboxamide
SMILESCOc1cccc(-c2nc(C(=O)NC(C)C3CCCCC3)c(O)c(=O)[nH]2)n1
InChIInChI=1S/C19H24N4O4/c1-11(12-7-4-3-5-8-12)20-18(25)15-16(24)19(26)23-17(22-15)13-9-6-10-14(21-13)27-2/h6,9-12,24H,3-5,7-8H2,1-2H3,(H,20,25)(H,22,23,26)
InChIKeyWZZWAOTZQTWVLT-UHFFFAOYSA-N
MW372.43 g/mol
LogP2.24
Rot. Bonds5

About N-(1-cyclohexylethyl)-5-hydroxy-2-(6-methoxy-2-pyridinyl)-6-oxo-1H-pyrimidine-4-carboxamide

N-(1-cyclohexylethyl)-5-hydroxy-2-(6-methoxy-2-pyridinyl)-6-oxo-1H-pyrimidine-4-carboxamide (PubChem CID 137297015) has the molecular formula C19H24N4O4 and a molecular weight of 372.43 g/mol. Its IUPAC name is N-(1-cyclohexylethyl)-5-hydroxy-2-(6-methoxy-2-pyridinyl)-6-oxo-1H-pyrimidine-4-carboxamide.

Molecular Properties

Compound NameN-(1-cyclohexylethyl)-5-hydroxy-2-(6-methoxy-2-pyridinyl)-6-oxo-1H-pyrimidine-4-carboxamide
PubChem CID137297015
Molecular FormulaC19H24N4O4
Molecular Weight372.43 g/mol
Exact Mass372.18
IUPAC NameN-(1-cyclohexylethyl)-5-hydroxy-2-(6-methoxy-2-pyridinyl)-6-oxo-1H-pyrimidine-4-carboxamide
SMILESCOc1cccc(-c2nc(C(=O)NC(C)C3CCCCC3)c(O)c(=O)[nH]2)n1
InChIInChI=1S/C19H24N4O4/c1-11(12-7-4-3-5-8-12)20-18(25)15-16(24)19(26)23-17(22-15)13-9-6-10-14(21-13)27-2/h6,9-12,24H,3-5,7-8H2,1-2H3,(H,20,25)(H,22,23,26)
InChIKeyWZZWAOTZQTWVLT-UHFFFAOYSA-N
XLogP2.24
TPSA117.20 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.43
LogP ≤ 52.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze N-(1-cyclohexylethyl)-5-hydroxy-2-(6-methoxy-2-pyridinyl)-6-oxo-1H-pyrimidine-4-carboxamide with MolForge

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Related Compounds

N-[(1R)-1-cyclohexylethyl]-5-hydroxy-2-(5-methyl-2-pyridinyl)-6-oxo-1H-pyrimidine-4-carboxamide
CID 137297033
2-[4-[[(1R)-1-cyclohexylethyl]carbamoyl]-5-hydroxy-6-oxo-1H-pyrimidin-2-yl]pyridine-4-carboxylic acid
CID 137296976
[6-[4-[[(1R)-1-cyclohexylethyl]carbamoyl]-5-hydroxy-6-oxo-1H-pyrimidin-2-yl]-3-pyridinyl]carbamic acid
CID 137297093
N-[(1R)-1-cyclohexylethyl]-5-hydroxy-2-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-6-oxo-1H-pyrimidine-4-carboxamide
CID 137297084
N-[(1R)-1-cyclohexylethyl]-2-[4-[2-(dimethylamino)ethyl]-2-pyridinyl]-5-hydroxy-6-oxo-1H-pyrimidine-4-carboxamide
CID 137297111
N-(1-cyclopropylethyl)-4-oxo-3H-phthalazine-1-carboxamide
CID 43400571
5-bromo-2-(6-methoxy-2-pyridinyl)-4-propan-2-yl-1H-pyrimidin-6-one
CID 136831512
N-(1-cyclobutylethyl)-1H-indazole-3-carboxamide
CID 113338562
4-hydroxy-2-(6-methoxy-2-pyridinyl)-1H-pyrimidin-6-one
CID 103347853
N-[(1R)-1-cyclohexylethyl]-2-(propan-2-ylamino)benzamide
CID 81389065
5-hydroxy-N-(2-methoxy-2-phenylethyl)-6-oxo-2-pyridin-2-yl-1H-pyrimidine-4-carboxamide
CID 137037001
N-(1-cyclopentylethyl)-3-hydroxy-2-methylbenzamide
CID 82828967

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexylethyl)-5-hydroxy-2-(6-methoxy-2-pyridinyl)-6-oxo-1H-pyrimidine-4-carboxamide?
The IUPAC name of N-(1-cyclohexylethyl)-5-hydroxy-2-(6-methoxy-2-pyridinyl)-6-oxo-1H-pyrimidine-4-carboxamide (CID 137297015) is N-(1-cyclohexylethyl)-5-hydroxy-2-(6-methoxy-2-pyridinyl)-6-oxo-1H-pyrimidine-4-carboxamide.
What is the SMILES notation for N-(1-cyclohexylethyl)-5-hydroxy-2-(6-methoxy-2-pyridinyl)-6-oxo-1H-pyrimidine-4-carboxamide?
The canonical SMILES for N-(1-cyclohexylethyl)-5-hydroxy-2-(6-methoxy-2-pyridinyl)-6-oxo-1H-pyrimidine-4-carboxamide is COc1cccc(-c2nc(C(=O)NC(C)C3CCCCC3)c(O)c(=O)[nH]2)n1.
What is the InChIKey of N-(1-cyclohexylethyl)-5-hydroxy-2-(6-methoxy-2-pyridinyl)-6-oxo-1H-pyrimidine-4-carboxamide?
The InChIKey is WZZWAOTZQTWVLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O4/c1-11(12-7-4-3-5-8-12)20-18(25)15-16(24)19(26)23-17(22-15)13-9-6-10-14(21-13)27-2/h6,9-12,24H,3-5,7-8H2,1-2H3,(H,20,25)(H,22,23,26).
What are the key properties of N-(1-cyclohexylethyl)-5-hydroxy-2-(6-methoxy-2-pyridinyl)-6-oxo-1H-pyrimidine-4-carboxamide?
N-(1-cyclohexylethyl)-5-hydroxy-2-(6-methoxy-2-pyridinyl)-6-oxo-1H-pyrimidine-4-carboxamide has a molecular weight of 372.43 g/mol, XLogP of 2.24, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexylethyl)-5-hydroxy-2-(6-methoxy-2-pyridinyl)-6-oxo-1H-pyrimidine-4-carboxamide is sourced from PubChem (CID 137297015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).