4-(cyclohexylamino)-6-piperidin-1-yl-1,3,5-triazine-2-carbonitrile

C15H22N6 — CID 11173697

IUPAC4-(cyclohexylamino)-6-piperidin-1-yl-1,3,5-triazine-2-carbonitrile
SMILESN#Cc1nc(NC2CCCCC2)nc(N2CCCCC2)n1
InChIInChI=1S/C15H22N6/c16-11-13-18-14(17-12-7-3-1-4-8-12)20-15(19-13)21-9-5-2-6-10-21/h12H,1-10H2,(H,17,18,19,20)
InChIKeyDSQXHWQRPWZPAW-UHFFFAOYSA-N
MW286.38 g/mol
LogP2.48
Rot. Bonds3

About 4-(cyclohexylamino)-6-piperidin-1-yl-1,3,5-triazine-2-carbonitrile

4-(cyclohexylamino)-6-piperidin-1-yl-1,3,5-triazine-2-carbonitrile (PubChem CID 11173697) has the molecular formula C15H22N6 and a molecular weight of 286.38 g/mol. Its IUPAC name is 4-(cyclohexylamino)-6-piperidin-1-yl-1,3,5-triazine-2-carbonitrile.

Molecular Properties

Compound Name4-(cyclohexylamino)-6-piperidin-1-yl-1,3,5-triazine-2-carbonitrile
PubChem CID11173697
Molecular FormulaC15H22N6
Molecular Weight286.38 g/mol
Exact Mass286.19
IUPAC Name4-(cyclohexylamino)-6-piperidin-1-yl-1,3,5-triazine-2-carbonitrile
SMILESN#Cc1nc(NC2CCCCC2)nc(N2CCCCC2)n1
InChIInChI=1S/C15H22N6/c16-11-13-18-14(17-12-7-3-1-4-8-12)20-15(19-13)21-9-5-2-6-10-21/h12H,1-10H2,(H,17,18,19,20)
InChIKeyDSQXHWQRPWZPAW-UHFFFAOYSA-N
XLogP2.48
TPSA77.73 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-chloro-N-cycloheptyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
CID 62870590
4-chloro-N-cyclopropyl-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 62869030
2-N-(oxan-4-yl)-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine
CID 80789723
4-[[4-(azepan-1-yl)-6-methoxy-1,3,5-triazin-2-yl]amino]cyclohexan-1-ol
CID 133344596
2-N-cyclopropyl-4-N-propyl-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine
CID 80770624
4-hydrazinyl-N-(oxan-3-yl)-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 80906487
4-N-methyl-2-N-(1-methylpiperidin-3-yl)-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine
CID 80776311
6-(azepan-1-yl)-2-N-cycloheptyl-4-N-(3-fluoro-4-methoxyphenyl)-1,3,5-triazine-2,4-diamine
CID 10296205
N-cycloheptyl-2-piperidin-1-ylpyrimidin-4-amine
CID 112884682
N-cycloheptyl-2-pyrrolidin-1-ylpyrimidin-4-amine
CID 112884053
2-N-(2-methylcycloheptyl)-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine
CID 80830801
6-piperidin-1-yl-2-N-(2,2,3,3-tetramethylcyclopropyl)-1,3,5-triazine-2,4-diamine
CID 80836332

Frequently Asked Questions

What is the IUPAC name of 4-(cyclohexylamino)-6-piperidin-1-yl-1,3,5-triazine-2-carbonitrile?
The IUPAC name of 4-(cyclohexylamino)-6-piperidin-1-yl-1,3,5-triazine-2-carbonitrile (CID 11173697) is 4-(cyclohexylamino)-6-piperidin-1-yl-1,3,5-triazine-2-carbonitrile.
What is the SMILES notation for 4-(cyclohexylamino)-6-piperidin-1-yl-1,3,5-triazine-2-carbonitrile?
The canonical SMILES for 4-(cyclohexylamino)-6-piperidin-1-yl-1,3,5-triazine-2-carbonitrile is N#Cc1nc(NC2CCCCC2)nc(N2CCCCC2)n1.
What is the InChIKey of 4-(cyclohexylamino)-6-piperidin-1-yl-1,3,5-triazine-2-carbonitrile?
The InChIKey is DSQXHWQRPWZPAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N6/c16-11-13-18-14(17-12-7-3-1-4-8-12)20-15(19-13)21-9-5-2-6-10-21/h12H,1-10H2,(H,17,18,19,20).
What are the key properties of 4-(cyclohexylamino)-6-piperidin-1-yl-1,3,5-triazine-2-carbonitrile?
4-(cyclohexylamino)-6-piperidin-1-yl-1,3,5-triazine-2-carbonitrile has a molecular weight of 286.38 g/mol, XLogP of 2.48, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclohexylamino)-6-piperidin-1-yl-1,3,5-triazine-2-carbonitrile is sourced from PubChem (CID 11173697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).