2-ethyl-4-pyrrolidin-1-yl-1H-pyrimidin-6-one

C10H15N3O — CID 137008954

IUPAC2-ethyl-4-pyrrolidin-1-yl-1H-pyrimidin-6-one
SMILESCCc1nc(N2CCCC2)cc(=O)[nH]1
InChIInChI=1S/C10H15N3O/c1-2-8-11-9(7-10(14)12-8)13-5-3-4-6-13/h7H,2-6H2,1H3,(H,11,12,14)
InChIKeySEOLFQSEHFDOAK-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.93
Rot. Bonds2

About 2-ethyl-4-pyrrolidin-1-yl-1H-pyrimidin-6-one

2-ethyl-4-pyrrolidin-1-yl-1H-pyrimidin-6-one (PubChem CID 137008954) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-ethyl-4-pyrrolidin-1-yl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-ethyl-4-pyrrolidin-1-yl-1H-pyrimidin-6-one
PubChem CID137008954
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name2-ethyl-4-pyrrolidin-1-yl-1H-pyrimidin-6-one
SMILESCCc1nc(N2CCCC2)cc(=O)[nH]1
InChIInChI=1S/C10H15N3O/c1-2-8-11-9(7-10(14)12-8)13-5-3-4-6-13/h7H,2-6H2,1H3,(H,11,12,14)
InChIKeySEOLFQSEHFDOAK-UHFFFAOYSA-N
XLogP0.93
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-ethyl-4-pyrrolidin-1-yl-1H-pyrimidin-6-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-Amino-2-(pyrrolidin-1-yl)pyrimidin-4(1H)-one
CID 135587489
2-methyl-4-[3-(trifluoromethyl)pyrrolidin-1-yl]-1H-pyrimidin-6-one
CID 136951448
2-methyl-4-[methyl(3,3,3-trifluoropropyl)amino]-1H-pyrimidin-6-one
CID 136957958
2-ethyl-4-(4,4,4-trifluorobutylamino)-1H-pyrimidin-6-one
CID 136976587
2-ethyl-4-[ethyl(2,2,2-trifluoroethyl)amino]-1H-pyrimidin-6-one
CID 136989922
2-ethyl-4-[methyl(2,2,2-trifluoroethyl)amino]-1H-pyrimidin-6-one
CID 137009212
2-ethyl-4-[methyl(3,3,3-trifluoropropyl)amino]-1H-pyrimidin-6-one
CID 137009785
4-[2,2-difluoroethyl(methyl)amino]-2-ethyl-1H-pyrimidin-6-one
CID 137009955
2-ethyl-4-(2-fluoroethylamino)-1H-pyrimidin-6-one
CID 137262841
(6S)-6-amino-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-4-one
CID 130324021
2-(pyrrolidin-1-ylmethyl)-1H-pyrimidin-6-one
CID 133681607
6-(Dimethylamino)-2-methyl-4-pyrimidinol
CID 135689647

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-pyrrolidin-1-yl-1H-pyrimidin-6-one?
The IUPAC name of 2-ethyl-4-pyrrolidin-1-yl-1H-pyrimidin-6-one (CID 137008954) is 2-ethyl-4-pyrrolidin-1-yl-1H-pyrimidin-6-one.
What is the SMILES notation for 2-ethyl-4-pyrrolidin-1-yl-1H-pyrimidin-6-one?
The canonical SMILES for 2-ethyl-4-pyrrolidin-1-yl-1H-pyrimidin-6-one is CCc1nc(N2CCCC2)cc(=O)[nH]1.
What is the InChIKey of 2-ethyl-4-pyrrolidin-1-yl-1H-pyrimidin-6-one?
The InChIKey is SEOLFQSEHFDOAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-2-8-11-9(7-10(14)12-8)13-5-3-4-6-13/h7H,2-6H2,1H3,(H,11,12,14).
What are the key properties of 2-ethyl-4-pyrrolidin-1-yl-1H-pyrimidin-6-one?
2-ethyl-4-pyrrolidin-1-yl-1H-pyrimidin-6-one has a molecular weight of 193.25 g/mol, XLogP of 0.93, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-pyrrolidin-1-yl-1H-pyrimidin-6-one is sourced from PubChem (CID 137008954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).