N-(6-oxo-1H-pyrimidin-2-yl)cyclopropanecarboxamide

C8H9N3O2 — CID 123394548

IUPACN-(6-oxo-1H-pyrimidin-2-yl)cyclopropanecarboxamide
SMILESO=C(Nc1nccc(=O)[nH]1)C1CC1
InChIInChI=1S/C8H9N3O2/c12-6-3-4-9-8(10-6)11-7(13)5-1-2-5/h3-5H,1-2H2,(H2,9,10,11,12,13)
InChIKeyOURUSAWOTKDNKL-UHFFFAOYSA-N
MW179.18 g/mol
LogP0.12
Rot. Bonds2

About N-(6-oxo-1H-pyrimidin-2-yl)cyclopropanecarboxamide

N-(6-oxo-1H-pyrimidin-2-yl)cyclopropanecarboxamide (PubChem CID 123394548) has the molecular formula C8H9N3O2 and a molecular weight of 179.18 g/mol. Its IUPAC name is N-(6-oxo-1H-pyrimidin-2-yl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(6-oxo-1H-pyrimidin-2-yl)cyclopropanecarboxamide
PubChem CID123394548
Molecular FormulaC8H9N3O2
Molecular Weight179.18 g/mol
Exact Mass179.07
IUPAC NameN-(6-oxo-1H-pyrimidin-2-yl)cyclopropanecarboxamide
SMILESO=C(Nc1nccc(=O)[nH]1)C1CC1
InChIInChI=1S/C8H9N3O2/c12-6-3-4-9-8(10-6)11-7(13)5-1-2-5/h3-5H,1-2H2,(H2,9,10,11,12,13)
InChIKeyOURUSAWOTKDNKL-UHFFFAOYSA-N
XLogP0.12
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.18
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(chloroamino)-1H-pyrimidin-6-one
CID 118878387
N-(2,4-dimethyl-3-pyridinyl)cyclopropanecarboxamide
CID 130527162
N-(1H-imidazol-2-yl)oxane-4-carboxamide
CID 60967951
2-[[1-amino-3-(1-methylpiperidin-4-yl)iminoprop-1-en-2-yl]amino]-1H-pyrimidin-6-one
CID 167535467
(3R,4R)-1-methyl-2-oxo-N-(6-oxo-1H-pyrimidin-2-yl)-4-[4-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide
CID 134412469
4-(aminomethyl)-N-(6-oxo-1H-pyridazin-3-yl)cyclohexane-1-carboxamide
CID 104963823
2-[(1-methylsulfinylpiperidin-4-yl)amino]-1H-pyrimidin-6-one
CID 126668694
1-N,4-N-bis(pyrazolo[1,5-a]pyrimidin-7-yl)cyclohexane-1,4-dicarboxamide
CID 56573678
N-(6-oxo-1H-pyridin-3-yl)cyclopropanecarboxamide
CID 110724856
cyclohexanamine;2-(2-hydroxyethylamino)-1H-pyrimidin-6-one
CID 145268956
N-[4-(5-cyclopropyl-2-methyl-1H-imidazol-4-yl)-2-pyridinyl]cyclopropanecarboxamide
CID 155562118
N-(4-ethyl-2-pyridinyl)cyclopropanecarboxamide
CID 89291693

Frequently Asked Questions

What is the IUPAC name of N-(6-oxo-1H-pyrimidin-2-yl)cyclopropanecarboxamide?
The IUPAC name of N-(6-oxo-1H-pyrimidin-2-yl)cyclopropanecarboxamide (CID 123394548) is N-(6-oxo-1H-pyrimidin-2-yl)cyclopropanecarboxamide.
What is the SMILES notation for N-(6-oxo-1H-pyrimidin-2-yl)cyclopropanecarboxamide?
The canonical SMILES for N-(6-oxo-1H-pyrimidin-2-yl)cyclopropanecarboxamide is O=C(Nc1nccc(=O)[nH]1)C1CC1.
What is the InChIKey of N-(6-oxo-1H-pyrimidin-2-yl)cyclopropanecarboxamide?
The InChIKey is OURUSAWOTKDNKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O2/c12-6-3-4-9-8(10-6)11-7(13)5-1-2-5/h3-5H,1-2H2,(H2,9,10,11,12,13).
What are the key properties of N-(6-oxo-1H-pyrimidin-2-yl)cyclopropanecarboxamide?
N-(6-oxo-1H-pyrimidin-2-yl)cyclopropanecarboxamide has a molecular weight of 179.18 g/mol, XLogP of 0.12, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-oxo-1H-pyrimidin-2-yl)cyclopropanecarboxamide is sourced from PubChem (CID 123394548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).