3-cyclohexyl-5-[(dimethylamino)methyl]-1,6-dimethylpyrimidine-2,4-dione

C15H25N3O2 — CID 3041142

IUPAC3-cyclohexyl-5-[(dimethylamino)methyl]-1,6-dimethylpyrimidine-2,4-dione
SMILESCc1c(CN(C)C)c(=O)n(C2CCCCC2)c(=O)n1C
InChIInChI=1S/C15H25N3O2/c1-11-13(10-16(2)3)14(19)18(15(20)17(11)4)12-8-6-5-7-9-12/h12H,5-10H2,1-4H3
InChIKeyQPAOQMAUBXSDPU-UHFFFAOYSA-N
MW279.38 g/mol
LogP1.42
Rot. Bonds3

About 3-cyclohexyl-5-[(dimethylamino)methyl]-1,6-dimethylpyrimidine-2,4-dione

3-cyclohexyl-5-[(dimethylamino)methyl]-1,6-dimethylpyrimidine-2,4-dione (PubChem CID 3041142) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is 3-cyclohexyl-5-[(dimethylamino)methyl]-1,6-dimethylpyrimidine-2,4-dione.

Molecular Properties

Compound Name3-cyclohexyl-5-[(dimethylamino)methyl]-1,6-dimethylpyrimidine-2,4-dione
PubChem CID3041142
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC Name3-cyclohexyl-5-[(dimethylamino)methyl]-1,6-dimethylpyrimidine-2,4-dione
SMILESCc1c(CN(C)C)c(=O)n(C2CCCCC2)c(=O)n1C
InChIInChI=1S/C15H25N3O2/c1-11-13(10-16(2)3)14(19)18(15(20)17(11)4)12-8-6-5-7-9-12/h12H,5-10H2,1-4H3
InChIKeyQPAOQMAUBXSDPU-UHFFFAOYSA-N
XLogP1.42
TPSA47.24 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

Uracil, 3-cyclohexyl-1,6-dimethyl-
CID 202192
6-Methyl-5-(1-piperidinylmethyl)-2,4-pyrimidinediol
CID 233789
Uracil, 3-cyclohexyl-1,6-dimethyl-5-dimethylamino-
CID 116088
Uracil, 1-cyclohexyl-3,6-dimethyl-5-dimethylamino-
CID 208422
Uracil, 1-cyclohexyl-5-((dimethylamino)methyl)-3-methyl-, monohydrochloride
CID 3041129
Uracil, 3-cyclohexyl-5-((dimethylamino)methyl)-1-methyl-, monohydrochloride
CID 3041133
Uracil, 1-cyclohexyl-3,6-dimethyl-5-((dimethylamino)methyl)-, monohydrochloride
CID 3041135
Uracil, 3-cyclohexyl-1,6-dimethyl-5-((dimethylamino)methyl)-, monohydrochloride
CID 3041141
Uracil, 3-cyclohexyl-1,6-dimethyl-5-(ethylmethylamino)-
CID 21149960
5-[(Cyclohexylamino)methyl]-1-(ethoxymethyl)-6-methylpyrimidine-2,4-dione
CID 44436376
3-Cyclohexyl-6-hydroxy-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboximidamide
CID 367238
3-Cyclohexyl-5,6-dimethyluracil
CID 15571333

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-5-[(dimethylamino)methyl]-1,6-dimethylpyrimidine-2,4-dione?
The IUPAC name of 3-cyclohexyl-5-[(dimethylamino)methyl]-1,6-dimethylpyrimidine-2,4-dione (CID 3041142) is 3-cyclohexyl-5-[(dimethylamino)methyl]-1,6-dimethylpyrimidine-2,4-dione.
What is the SMILES notation for 3-cyclohexyl-5-[(dimethylamino)methyl]-1,6-dimethylpyrimidine-2,4-dione?
The canonical SMILES for 3-cyclohexyl-5-[(dimethylamino)methyl]-1,6-dimethylpyrimidine-2,4-dione is Cc1c(CN(C)C)c(=O)n(C2CCCCC2)c(=O)n1C.
What is the InChIKey of 3-cyclohexyl-5-[(dimethylamino)methyl]-1,6-dimethylpyrimidine-2,4-dione?
The InChIKey is QPAOQMAUBXSDPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-11-13(10-16(2)3)14(19)18(15(20)17(11)4)12-8-6-5-7-9-12/h12H,5-10H2,1-4H3.
What are the key properties of 3-cyclohexyl-5-[(dimethylamino)methyl]-1,6-dimethylpyrimidine-2,4-dione?
3-cyclohexyl-5-[(dimethylamino)methyl]-1,6-dimethylpyrimidine-2,4-dione has a molecular weight of 279.38 g/mol, XLogP of 1.42, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-5-[(dimethylamino)methyl]-1,6-dimethylpyrimidine-2,4-dione is sourced from PubChem (CID 3041142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).