N-cyclopentyl-2-methyl-6-oxo-1H-pyrimidine-5-carboxamide

C11H15N3O2 — CID 95916099

IUPACN-cyclopentyl-2-methyl-6-oxo-1H-pyrimidine-5-carboxamide
SMILESCc1ncc(C(=O)NC2CCCC2)c(=O)[nH]1
InChIInChI=1S/C11H15N3O2/c1-7-12-6-9(10(15)13-7)11(16)14-8-4-2-3-5-8/h6,8H,2-5H2,1H3,(H,14,16)(H,12,13,15)
InChIKeyITGJYCXYHCZHMF-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.75
Rot. Bonds2

About N-cyclopentyl-2-methyl-6-oxo-1H-pyrimidine-5-carboxamide

N-cyclopentyl-2-methyl-6-oxo-1H-pyrimidine-5-carboxamide (PubChem CID 95916099) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is N-cyclopentyl-2-methyl-6-oxo-1H-pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-2-methyl-6-oxo-1H-pyrimidine-5-carboxamide
PubChem CID95916099
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC NameN-cyclopentyl-2-methyl-6-oxo-1H-pyrimidine-5-carboxamide
SMILESCc1ncc(C(=O)NC2CCCC2)c(=O)[nH]1
InChIInChI=1S/C11H15N3O2/c1-7-12-6-9(10(15)13-7)11(16)14-8-4-2-3-5-8/h6,8H,2-5H2,1H3,(H,14,16)(H,12,13,15)
InChIKeyITGJYCXYHCZHMF-UHFFFAOYSA-N
XLogP0.75
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-4-oxo-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidine-3-carboxamide
CID 20438535
3-cyclopentyl-7-methyl-6H-pyrimido[4,5-d]pyrimidine-2,5-dione
CID 163365413
1,6-dimethyl-4-oxo-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-1-ium-3-carboxamide
CID 20438529
N,2-dimethyl-6-oxo-1,6-dihydropyrimidine-5-carboxamide
CID 50989028
N-[rel-(1R,3R)-3-aminocyclopentyl]-2-isopropyl-6-oxo-1,6-dihydro-5-pyrimidinecarboxamide hydrochloride
CID 56749058
5-({2-[2-(dimethylamino)ethyl]-1-piperidinyl}carbonyl)-2-methyl-4(3H)-pyrimidinone
CID 56914559
N-[(2-methyl-6-oxo-1H-pyrimidin-5-yl)methyl]acetamide
CID 76852062
5-methyl-2-(pyrrolidin-2-ylmethyl)-1H-pyrimidin-6-one
CID 84664926
5-[(4-aminoazepan-1-yl)carbonyl]-2-methylpyrimidin-4(3H)-one
CID 91766559
N-(1-cyclopentylpiperidin-4-yl)-6-oxo-1,6-dihydropyrimidine-5-carboxamide
CID 91771766
5-[(2R)-2-[2-(dimethylamino)ethyl]piperidine-1-carbonyl]-2-methyl-1H-pyrimidin-6-one
CID 95896274
5-[(2S)-2-[2-(dimethylamino)ethyl]piperidine-1-carbonyl]-2-methyl-1H-pyrimidin-6-one
CID 95896275

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-methyl-6-oxo-1H-pyrimidine-5-carboxamide?
The IUPAC name of N-cyclopentyl-2-methyl-6-oxo-1H-pyrimidine-5-carboxamide (CID 95916099) is N-cyclopentyl-2-methyl-6-oxo-1H-pyrimidine-5-carboxamide.
What is the SMILES notation for N-cyclopentyl-2-methyl-6-oxo-1H-pyrimidine-5-carboxamide?
The canonical SMILES for N-cyclopentyl-2-methyl-6-oxo-1H-pyrimidine-5-carboxamide is Cc1ncc(C(=O)NC2CCCC2)c(=O)[nH]1.
What is the InChIKey of N-cyclopentyl-2-methyl-6-oxo-1H-pyrimidine-5-carboxamide?
The InChIKey is ITGJYCXYHCZHMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c1-7-12-6-9(10(15)13-7)11(16)14-8-4-2-3-5-8/h6,8H,2-5H2,1H3,(H,14,16)(H,12,13,15).
What are the key properties of N-cyclopentyl-2-methyl-6-oxo-1H-pyrimidine-5-carboxamide?
N-cyclopentyl-2-methyl-6-oxo-1H-pyrimidine-5-carboxamide has a molecular weight of 221.26 g/mol, XLogP of 0.75, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-methyl-6-oxo-1H-pyrimidine-5-carboxamide is sourced from PubChem (CID 95916099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).