N-cyclohexyl-6-(2-ethylpiperidin-1-yl)pyrimidin-4-amine

C17H28N4 — CID 112856254

IUPACN-cyclohexyl-6-(2-ethylpiperidin-1-yl)pyrimidin-4-amine
SMILESCCC1CCCCN1c1cc(NC2CCCCC2)ncn1
InChIInChI=1S/C17H28N4/c1-2-15-10-6-7-11-21(15)17-12-16(18-13-19-17)20-14-8-4-3-5-9-14/h12-15H,2-11H2,1H3,(H,18,19,20)
InChIKeyDLWPMBNGZOPQDI-UHFFFAOYSA-N
MW288.44 g/mol
LogP3.99
Rot. Bonds4

About N-cyclohexyl-6-(2-ethylpiperidin-1-yl)pyrimidin-4-amine

N-cyclohexyl-6-(2-ethylpiperidin-1-yl)pyrimidin-4-amine (PubChem CID 112856254) has the molecular formula C17H28N4 and a molecular weight of 288.44 g/mol. Its IUPAC name is N-cyclohexyl-6-(2-ethylpiperidin-1-yl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-cyclohexyl-6-(2-ethylpiperidin-1-yl)pyrimidin-4-amine
PubChem CID112856254
Molecular FormulaC17H28N4
Molecular Weight288.44 g/mol
Exact Mass288.23
IUPAC NameN-cyclohexyl-6-(2-ethylpiperidin-1-yl)pyrimidin-4-amine
SMILESCCC1CCCCN1c1cc(NC2CCCCC2)ncn1
InChIInChI=1S/C17H28N4/c1-2-15-10-6-7-11-21(15)17-12-16(18-13-19-17)20-14-8-4-3-5-9-14/h12-15H,2-11H2,1H3,(H,18,19,20)
InChIKeyDLWPMBNGZOPQDI-UHFFFAOYSA-N
XLogP3.99
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(2-ethylazepan-1-yl)-N-methylpyrimidin-4-amine
CID 104693081
6-[(2S)-2-ethylpiperidin-1-yl]-N-methylpyrimidin-4-amine
CID 129372140
N-cyclohexyl-6-(2-ethylpiperidin-1-yl)-2-methylpyrimidin-4-amine
CID 112869044
N-ethyl-6-(2-ethylpyrrolidin-1-yl)pyrimidin-4-amine
CID 80798245
N-[6-(2-ethylpiperidin-1-yl)pyrimidin-4-yl]-N',N'-dimethylethane-1,2-diamine
CID 112857436
4-[[6-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]pyrimidin-4-yl]amino]cyclohexan-1-ol
CID 95763811
N-cyclopentyl-6-(2-ethylpiperidin-1-yl)pyrimidine-4-carboxamide
CID 109341455
[6-(cycloheptylamino)pyrimidin-4-yl]-(2-ethylpiperidin-1-yl)methanone
CID 109353967
N-(3-chloro-4-fluorophenyl)-6-(2-ethylpiperidin-1-yl)pyrimidin-4-amine
CID 112864331
N-(1,3-benzodioxol-5-yl)-6-(2-ethylpiperidin-1-yl)pyrimidin-4-amine
CID 112864365
N-[(3,4-dimethoxyphenyl)methyl]-6-(2-ethylpiperidin-1-yl)pyrimidin-4-amine
CID 112862577
4-(2-ethylpyrrolidin-1-yl)-6-fluoropyrimidine
CID 115416581

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-6-(2-ethylpiperidin-1-yl)pyrimidin-4-amine?
The IUPAC name of N-cyclohexyl-6-(2-ethylpiperidin-1-yl)pyrimidin-4-amine (CID 112856254) is N-cyclohexyl-6-(2-ethylpiperidin-1-yl)pyrimidin-4-amine.
What is the SMILES notation for N-cyclohexyl-6-(2-ethylpiperidin-1-yl)pyrimidin-4-amine?
The canonical SMILES for N-cyclohexyl-6-(2-ethylpiperidin-1-yl)pyrimidin-4-amine is CCC1CCCCN1c1cc(NC2CCCCC2)ncn1.
What is the InChIKey of N-cyclohexyl-6-(2-ethylpiperidin-1-yl)pyrimidin-4-amine?
The InChIKey is DLWPMBNGZOPQDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4/c1-2-15-10-6-7-11-21(15)17-12-16(18-13-19-17)20-14-8-4-3-5-9-14/h12-15H,2-11H2,1H3,(H,18,19,20).
What are the key properties of N-cyclohexyl-6-(2-ethylpiperidin-1-yl)pyrimidin-4-amine?
N-cyclohexyl-6-(2-ethylpiperidin-1-yl)pyrimidin-4-amine has a molecular weight of 288.44 g/mol, XLogP of 3.99, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-6-(2-ethylpiperidin-1-yl)pyrimidin-4-amine is sourced from PubChem (CID 112856254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).