4-(cyclopropylmethylamino)-2-ethyl-1H-pyrimidin-6-one

C10H15N3O — CID 136973540

IUPAC4-(cyclopropylmethylamino)-2-ethyl-1H-pyrimidin-6-one
SMILESCCc1nc(NCC2CC2)cc(=O)[nH]1
InChIInChI=1S/C10H15N3O/c1-2-8-12-9(5-10(14)13-8)11-6-7-3-4-7/h5,7H,2-4,6H2,1H3,(H2,11,12,13,14)
InChIKeyBYPOPPYGGVXFIA-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.15
Rot. Bonds4

About 4-(cyclopropylmethylamino)-2-ethyl-1H-pyrimidin-6-one

4-(cyclopropylmethylamino)-2-ethyl-1H-pyrimidin-6-one (PubChem CID 136973540) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 4-(cyclopropylmethylamino)-2-ethyl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-(cyclopropylmethylamino)-2-ethyl-1H-pyrimidin-6-one
PubChem CID136973540
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name4-(cyclopropylmethylamino)-2-ethyl-1H-pyrimidin-6-one
SMILESCCc1nc(NCC2CC2)cc(=O)[nH]1
InChIInChI=1S/C10H15N3O/c1-2-8-12-9(5-10(14)13-8)11-6-7-3-4-7/h5,7H,2-4,6H2,1H3,(H2,11,12,13,14)
InChIKeyBYPOPPYGGVXFIA-UHFFFAOYSA-N
XLogP1.15
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-4-[(4-ethylcyclohexyl)methylamino]-1H-pyrimidin-6-one
CID 136974286
2-ethyl-4-[(1-methylpiperidin-3-yl)methylamino]-1H-pyrimidin-6-one
CID 137016321
4-[(1,1-dioxothiolan-2-yl)methylamino]-2-ethyl-1H-pyrimidin-6-one
CID 136976507
4-[(4-ethylcyclohexyl)methylamino]-2-propan-2-yl-1H-pyrimidin-6-one
CID 136974289
4-(cyclopropylmethoxy)-2-ethyl-1H-pyrimidin-6-one
CID 103240776
4-(2,2-dimethylbutylamino)-2-ethyl-1H-pyrimidin-6-one
CID 136768848
2-ethyl-4-(2-ethylsulfonylethylamino)-1H-pyrimidin-6-one
CID 136750490
2-ethyl-4-[(1-hydroxy-4-methylcyclohexyl)methylamino]-1H-pyrimidin-6-one
CID 136976085
2-ethyl-4-[2-[(2S)-pyrrolidin-2-yl]ethylamino]-1H-pyrimidin-6-one
CID 136879297
4-[[(E)-but-2-enyl]amino]-2-ethyl-1H-pyrimidin-6-one
CID 137273825
4-(cyclopent-3-en-1-ylamino)-2-ethyl-1H-pyrimidin-6-one
CID 136977072
4-(cyclobutylmethylamino)-2-cyclopropyl-1H-pyrimidin-6-one
CID 136973893

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropylmethylamino)-2-ethyl-1H-pyrimidin-6-one?
The IUPAC name of 4-(cyclopropylmethylamino)-2-ethyl-1H-pyrimidin-6-one (CID 136973540) is 4-(cyclopropylmethylamino)-2-ethyl-1H-pyrimidin-6-one.
What is the SMILES notation for 4-(cyclopropylmethylamino)-2-ethyl-1H-pyrimidin-6-one?
The canonical SMILES for 4-(cyclopropylmethylamino)-2-ethyl-1H-pyrimidin-6-one is CCc1nc(NCC2CC2)cc(=O)[nH]1.
What is the InChIKey of 4-(cyclopropylmethylamino)-2-ethyl-1H-pyrimidin-6-one?
The InChIKey is BYPOPPYGGVXFIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-2-8-12-9(5-10(14)13-8)11-6-7-3-4-7/h5,7H,2-4,6H2,1H3,(H2,11,12,13,14).
What are the key properties of 4-(cyclopropylmethylamino)-2-ethyl-1H-pyrimidin-6-one?
4-(cyclopropylmethylamino)-2-ethyl-1H-pyrimidin-6-one has a molecular weight of 193.25 g/mol, XLogP of 1.15, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylmethylamino)-2-ethyl-1H-pyrimidin-6-one is sourced from PubChem (CID 136973540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).