4-[[(Z)-but-2-en-2-yl]amino]-1,5-dimethylpyrimidin-2-one

C10H15N3O — CID 134389826

IUPAC4-[[(Z)-but-2-en-2-yl]amino]-1,5-dimethylpyrimidin-2-one
SMILESC/C=C(/C)Nc1nc(=O)n(C)cc1C
InChIInChI=1S/C10H15N3O/c1-5-8(3)11-9-7(2)6-13(4)10(14)12-9/h5-6H,1-4H3,(H,11,12,14)/b8-5-
InChIKeyCWDXWKYBNXQWAF-YVMONPNESA-N
MW193.25 g/mol
LogP1.42
Rot. Bonds2

About 4-[[(Z)-but-2-en-2-yl]amino]-1,5-dimethylpyrimidin-2-one

4-[[(Z)-but-2-en-2-yl]amino]-1,5-dimethylpyrimidin-2-one (PubChem CID 134389826) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 4-[[(Z)-but-2-en-2-yl]amino]-1,5-dimethylpyrimidin-2-one.

Molecular Properties

Compound Name4-[[(Z)-but-2-en-2-yl]amino]-1,5-dimethylpyrimidin-2-one
PubChem CID134389826
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name4-[[(Z)-but-2-en-2-yl]amino]-1,5-dimethylpyrimidin-2-one
SMILESC/C=C(/C)Nc1nc(=O)n(C)cc1C
InChIInChI=1S/C10H15N3O/c1-5-8(3)11-9-7(2)6-13(4)10(14)12-9/h5-6H,1-4H3,(H,11,12,14)/b8-5-
InChIKeyCWDXWKYBNXQWAF-YVMONPNESA-N
XLogP1.42
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-[[(Z)-but-2-en-2-yl]amino]-1,5-dimethylpyrimidin-2-one with MolForge

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Related Compounds

pyrimidin-2(1H)-one, 4-ethylamino-1,5-dimethyl-
CID 129928238
1-Methyl-4-tert-butylaminocytosine
CID 580782
1,5-Dimethyl-4-allylaminocytosine
CID 601688
4-(diethylamino)-6-methyl-1H-pyrimidin-2-one
CID 13789833
4-(dipropylamino)-6-methyl-1H-pyrimidin-2-one
CID 13789834
4-(diethylamino)-5,6-dimethyl-1H-pyrimidin-2-one
CID 21311519
3,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-2-one
CID 118005067
3,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-2-one;ethane
CID 142285345
1-Methyl-4-(3-methylbut-1-en-2-ylamino)pyrimidin-2-one
CID 155141468
Ethane;1-methyl-4-(3-methylbut-1-en-2-ylamino)pyrimidin-2-one
CID 155698627
3,6-dimethyl-7H-pyrrolo[2,3-d]pyrimidin-2-one;ethane
CID 156724457
1,5-Dimethyl-4-(propan-2-ylamino)pyrimidin-2-one
CID 164598724

Frequently Asked Questions

What is the IUPAC name of 4-[[(Z)-but-2-en-2-yl]amino]-1,5-dimethylpyrimidin-2-one?
The IUPAC name of 4-[[(Z)-but-2-en-2-yl]amino]-1,5-dimethylpyrimidin-2-one (CID 134389826) is 4-[[(Z)-but-2-en-2-yl]amino]-1,5-dimethylpyrimidin-2-one.
What is the SMILES notation for 4-[[(Z)-but-2-en-2-yl]amino]-1,5-dimethylpyrimidin-2-one?
The canonical SMILES for 4-[[(Z)-but-2-en-2-yl]amino]-1,5-dimethylpyrimidin-2-one is C/C=C(/C)Nc1nc(=O)n(C)cc1C.
What is the InChIKey of 4-[[(Z)-but-2-en-2-yl]amino]-1,5-dimethylpyrimidin-2-one?
The InChIKey is CWDXWKYBNXQWAF-YVMONPNESA-N. The full InChI is InChI=1S/C10H15N3O/c1-5-8(3)11-9-7(2)6-13(4)10(14)12-9/h5-6H,1-4H3,(H,11,12,14)/b8-5-.
What are the key properties of 4-[[(Z)-but-2-en-2-yl]amino]-1,5-dimethylpyrimidin-2-one?
4-[[(Z)-but-2-en-2-yl]amino]-1,5-dimethylpyrimidin-2-one has a molecular weight of 193.25 g/mol, XLogP of 1.42, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(Z)-but-2-en-2-yl]amino]-1,5-dimethylpyrimidin-2-one is sourced from PubChem (CID 134389826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).