3,5-dimethyl-N-(2-piperidin-2-ylcyclohexyl)-1H-pyrazol-4-amine

C16H28N4 — CID 79553657

IUPAC3,5-dimethyl-N-(2-piperidin-2-ylcyclohexyl)-1H-pyrazol-4-amine
SMILESCc1n[nH]c(C)c1NC1CCCCC1C1CCCCN1
InChIInChI=1S/C16H28N4/c1-11-16(12(2)20-19-11)18-15-9-4-3-7-13(15)14-8-5-6-10-17-14/h13-15,17-18H,3-10H2,1-2H3,(H,19,20)
InChIKeyVDPWUICIVJLFLW-UHFFFAOYSA-N
MW276.43 g/mol
LogP3.14
Rot. Bonds3

About 3,5-dimethyl-N-(2-piperidin-2-ylcyclohexyl)-1H-pyrazol-4-amine

3,5-dimethyl-N-(2-piperidin-2-ylcyclohexyl)-1H-pyrazol-4-amine (PubChem CID 79553657) has the molecular formula C16H28N4 and a molecular weight of 276.43 g/mol. Its IUPAC name is 3,5-dimethyl-N-(2-piperidin-2-ylcyclohexyl)-1H-pyrazol-4-amine.

Molecular Properties

Compound Name3,5-dimethyl-N-(2-piperidin-2-ylcyclohexyl)-1H-pyrazol-4-amine
PubChem CID79553657
Molecular FormulaC16H28N4
Molecular Weight276.43 g/mol
Exact Mass276.23
IUPAC Name3,5-dimethyl-N-(2-piperidin-2-ylcyclohexyl)-1H-pyrazol-4-amine
SMILESCc1n[nH]c(C)c1NC1CCCCC1C1CCCCN1
InChIInChI=1S/C16H28N4/c1-11-16(12(2)20-19-11)18-15-9-4-3-7-13(15)14-8-5-6-10-17-14/h13-15,17-18H,3-10H2,1-2H3,(H,19,20)
InChIKeyVDPWUICIVJLFLW-UHFFFAOYSA-N
XLogP3.14
TPSA52.74 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.43
LogP ≤ 53.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2,4,6-trimethyl-N-(2-pyrrolidin-2-ylcyclohexyl)aniline
CID 79536673
N-(2-bicyclo[3.1.0]hexanyl)-3,5-dimethyl-1H-pyrazol-4-amine
CID 130525381
5-methyl-N-(2-piperidin-2-ylcyclopentyl)-1,3,4-thiadiazol-2-amine
CID 107648271
3,5-dimethyl-N-(2-methylthian-3-yl)-1H-pyrazol-4-amine
CID 79957725
2,6-dibromo-N-(2-piperidin-2-ylcyclopentyl)aniline
CID 107597064
3,5-dimethyl-N-(2-methylsulfonylcyclopentyl)-1H-pyrazol-4-amine
CID 65044159
4-[(2-piperidin-2-ylcyclohexyl)amino]phenol
CID 79553578
2,6-dibromo-4-methyl-N-(2-pyrrolidin-2-ylcyclopentyl)aniline
CID 79543746
2,6-dichloro-4-fluoro-N-(2-piperidin-2-ylcyclopentyl)aniline
CID 83078172
N-(2-piperidin-2-ylcyclopentyl)pyrimidin-5-amine
CID 107587753
4-[(2-piperidin-2-ylcyclopentyl)amino]phenol
CID 79545447
1-methyl-N-(2-piperidin-2-ylcyclohexyl)pyrazol-4-amine
CID 79553269

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-N-(2-piperidin-2-ylcyclohexyl)-1H-pyrazol-4-amine?
The IUPAC name of 3,5-dimethyl-N-(2-piperidin-2-ylcyclohexyl)-1H-pyrazol-4-amine (CID 79553657) is 3,5-dimethyl-N-(2-piperidin-2-ylcyclohexyl)-1H-pyrazol-4-amine.
What is the SMILES notation for 3,5-dimethyl-N-(2-piperidin-2-ylcyclohexyl)-1H-pyrazol-4-amine?
The canonical SMILES for 3,5-dimethyl-N-(2-piperidin-2-ylcyclohexyl)-1H-pyrazol-4-amine is Cc1n[nH]c(C)c1NC1CCCCC1C1CCCCN1.
What is the InChIKey of 3,5-dimethyl-N-(2-piperidin-2-ylcyclohexyl)-1H-pyrazol-4-amine?
The InChIKey is VDPWUICIVJLFLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4/c1-11-16(12(2)20-19-11)18-15-9-4-3-7-13(15)14-8-5-6-10-17-14/h13-15,17-18H,3-10H2,1-2H3,(H,19,20).
What are the key properties of 3,5-dimethyl-N-(2-piperidin-2-ylcyclohexyl)-1H-pyrazol-4-amine?
3,5-dimethyl-N-(2-piperidin-2-ylcyclohexyl)-1H-pyrazol-4-amine has a molecular weight of 276.43 g/mol, XLogP of 3.14, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-N-(2-piperidin-2-ylcyclohexyl)-1H-pyrazol-4-amine is sourced from PubChem (CID 79553657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).