2-cyclohexyl-3,4-dihydropyrazol-5-amine

C9H17N3 — CID 12551425

IUPAC2-cyclohexyl-3,4-dihydropyrazol-5-amine
SMILESNC1=NN(C2CCCCC2)CC1
InChIInChI=1S/C9H17N3/c10-9-6-7-12(11-9)8-4-2-1-3-5-8/h8H,1-7H2,(H2,10,11)
InChIKeyGXWWQUZUAVXGIZ-UHFFFAOYSA-N
MW167.26 g/mol
LogP1.30
Rot. Bonds1

About 2-cyclohexyl-3,4-dihydropyrazol-5-amine

2-cyclohexyl-3,4-dihydropyrazol-5-amine (PubChem CID 12551425) has the molecular formula C9H17N3 and a molecular weight of 167.26 g/mol. Its IUPAC name is 2-cyclohexyl-3,4-dihydropyrazol-5-amine.

Molecular Properties

Compound Name2-cyclohexyl-3,4-dihydropyrazol-5-amine
PubChem CID12551425
Molecular FormulaC9H17N3
Molecular Weight167.26 g/mol
Exact Mass167.14
IUPAC Name2-cyclohexyl-3,4-dihydropyrazol-5-amine
SMILESNC1=NN(C2CCCCC2)CC1
InChIInChI=1S/C9H17N3/c10-9-6-7-12(11-9)8-4-2-1-3-5-8/h8H,1-7H2,(H2,10,11)
InChIKeyGXWWQUZUAVXGIZ-UHFFFAOYSA-N
XLogP1.30
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.26
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cycloheptyl-3,4-dihydropyrazol-5-amine
CID 83240724
7-cyclohexyl-5,6,8,9-tetrahydropyrazino[2,3-d]azepin-3-amine
CID 13037040
4-cyclohexyl-1,2,4-triazol-3-amine
CID 62710575
3-cyclohexyl-4H-imidazo[5,1-d][1,2,3,5]tetrazine-8-carboxamide
CID 68878949
(1,3-dicyclohexylimidazolidin-2-ylidene)rhodium
CID 142675127
1-cyclooctylpiperidine
CID 89210756
1-cyclohexylazocane
CID 23151203
1-cyclooctylpyrrolidine
CID 23277874
1-cyclohexyl-5-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-amine
CID 105495323
1-cyclodecylpyrrolidin-2-one
CID 138507623
1-cyclohexyl-8-cyclopentyl-2,3,4,5,6,7-hexahydro-1,8-naphthyridine
CID 90070602
4-amino-1-cyclohexyl-3,6-dihydro-2H-pyridine-5-carbonitrile
CID 163908046

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-3,4-dihydropyrazol-5-amine?
The IUPAC name of 2-cyclohexyl-3,4-dihydropyrazol-5-amine (CID 12551425) is 2-cyclohexyl-3,4-dihydropyrazol-5-amine.
What is the SMILES notation for 2-cyclohexyl-3,4-dihydropyrazol-5-amine?
The canonical SMILES for 2-cyclohexyl-3,4-dihydropyrazol-5-amine is NC1=NN(C2CCCCC2)CC1.
What is the InChIKey of 2-cyclohexyl-3,4-dihydropyrazol-5-amine?
The InChIKey is GXWWQUZUAVXGIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3/c10-9-6-7-12(11-9)8-4-2-1-3-5-8/h8H,1-7H2,(H2,10,11).
What are the key properties of 2-cyclohexyl-3,4-dihydropyrazol-5-amine?
2-cyclohexyl-3,4-dihydropyrazol-5-amine has a molecular weight of 167.26 g/mol, XLogP of 1.30, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-3,4-dihydropyrazol-5-amine is sourced from PubChem (CID 12551425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).