4-[[4-(ethylamino)cyclohexyl]-methylamino]-2-methyl-1H-pyrimidin-6-one

C14H24N4O — CID 136958278

IUPAC4-[[4-(ethylamino)cyclohexyl]-methylamino]-2-methyl-1H-pyrimidin-6-one
SMILESCCNC1CCC(N(C)c2cc(=O)[nH]c(C)n2)CC1
InChIInChI=1S/C14H24N4O/c1-4-15-11-5-7-12(8-6-11)18(3)13-9-14(19)17-10(2)16-13/h9,11-12,15H,4-8H2,1-3H3,(H,16,17,19)
InChIKeyVECUGCYKZRQUGP-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.44
Rot. Bonds4

About 4-[[4-(ethylamino)cyclohexyl]-methylamino]-2-methyl-1H-pyrimidin-6-one

4-[[4-(ethylamino)cyclohexyl]-methylamino]-2-methyl-1H-pyrimidin-6-one (PubChem CID 136958278) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-[[4-(ethylamino)cyclohexyl]-methylamino]-2-methyl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-[[4-(ethylamino)cyclohexyl]-methylamino]-2-methyl-1H-pyrimidin-6-one
PubChem CID136958278
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name4-[[4-(ethylamino)cyclohexyl]-methylamino]-2-methyl-1H-pyrimidin-6-one
SMILESCCNC1CCC(N(C)c2cc(=O)[nH]c(C)n2)CC1
InChIInChI=1S/C14H24N4O/c1-4-15-11-5-7-12(8-6-11)18(3)13-9-14(19)17-10(2)16-13/h9,11-12,15H,4-8H2,1-3H3,(H,16,17,19)
InChIKeyVECUGCYKZRQUGP-UHFFFAOYSA-N
XLogP1.44
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-[(4,4-Difluorocyclohexyl)amino]-2,3-dimethylpyrimidin-4-one
CID 177233933
2-Amino-6-(cyclohexylamino)pyrimidin-4(1h)-one
CID 135402393
4-Hydroxy-2-methyl-6-(piperidin-1-yl)pyrimidine
CID 137000217
2-[(4-aminocyclohexyl)-methylamino]-1H-pyrimidin-6-one
CID 140329312
3-[3-(Cyclohexylamino)propyl]-2,6-dimethylpyrimidin-4-one
CID 55236462
3-[2-(Cyclohexylamino)ethyl]-2,6-dimethylpyrimidin-4-one
CID 63793846
2-(1-Aminoethyl)-3-methyl-6-piperidin-1-ylpyrimidin-4-one
CID 84699557
2-methyl-4-(octylamino)-1H-pyrimidin-6-one
CID 135818518
4-(dodecylamino)-2-methyl-1H-pyrimidin-6-one
CID 135818519
6-amino-2-(cyclohexylamino)pyrimidin-4(3H)-one
CID 136070960
4-amino-2-(1-piperazin-1-ylbutyl)-1H-pyrimidin-6-one
CID 136077756
4-(dimethylamino)-2-(pyrrolidin-2-ylmethyl)-1H-pyrimidin-6-one
CID 136314512

Frequently Asked Questions

What is the IUPAC name of 4-[[4-(ethylamino)cyclohexyl]-methylamino]-2-methyl-1H-pyrimidin-6-one?
The IUPAC name of 4-[[4-(ethylamino)cyclohexyl]-methylamino]-2-methyl-1H-pyrimidin-6-one (CID 136958278) is 4-[[4-(ethylamino)cyclohexyl]-methylamino]-2-methyl-1H-pyrimidin-6-one.
What is the SMILES notation for 4-[[4-(ethylamino)cyclohexyl]-methylamino]-2-methyl-1H-pyrimidin-6-one?
The canonical SMILES for 4-[[4-(ethylamino)cyclohexyl]-methylamino]-2-methyl-1H-pyrimidin-6-one is CCNC1CCC(N(C)c2cc(=O)[nH]c(C)n2)CC1.
What is the InChIKey of 4-[[4-(ethylamino)cyclohexyl]-methylamino]-2-methyl-1H-pyrimidin-6-one?
The InChIKey is VECUGCYKZRQUGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-4-15-11-5-7-12(8-6-11)18(3)13-9-14(19)17-10(2)16-13/h9,11-12,15H,4-8H2,1-3H3,(H,16,17,19).
What are the key properties of 4-[[4-(ethylamino)cyclohexyl]-methylamino]-2-methyl-1H-pyrimidin-6-one?
4-[[4-(ethylamino)cyclohexyl]-methylamino]-2-methyl-1H-pyrimidin-6-one has a molecular weight of 264.37 g/mol, XLogP of 1.44, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-(ethylamino)cyclohexyl]-methylamino]-2-methyl-1H-pyrimidin-6-one is sourced from PubChem (CID 136958278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).