1-cyclohexyl-6,6-dimethyl-4,5-dihydrocyclopenta[d]pyrazole

C14H22N2 — CID 129024686

IUPAC1-cyclohexyl-6,6-dimethyl-4,5-dihydrocyclopenta[d]pyrazole
SMILESCC1(C)CCc2cnn(C3CCCCC3)c21
InChIInChI=1S/C14H22N2/c1-14(2)9-8-11-10-15-16(13(11)14)12-6-4-3-5-7-12/h10,12H,3-9H2,1-2H3
InChIKeyJEAGPNGMRHSONW-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.61
Rot. Bonds1

About 1-cyclohexyl-6,6-dimethyl-4,5-dihydrocyclopenta[d]pyrazole

1-cyclohexyl-6,6-dimethyl-4,5-dihydrocyclopenta[d]pyrazole (PubChem CID 129024686) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 1-cyclohexyl-6,6-dimethyl-4,5-dihydrocyclopenta[d]pyrazole.

Molecular Properties

Compound Name1-cyclohexyl-6,6-dimethyl-4,5-dihydrocyclopenta[d]pyrazole
PubChem CID129024686
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name1-cyclohexyl-6,6-dimethyl-4,5-dihydrocyclopenta[d]pyrazole
SMILESCC1(C)CCc2cnn(C3CCCCC3)c21
InChIInChI=1S/C14H22N2/c1-14(2)9-8-11-10-15-16(13(11)14)12-6-4-3-5-7-12/h10,12H,3-9H2,1-2H3
InChIKeyJEAGPNGMRHSONW-UHFFFAOYSA-N
XLogP3.61
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopentyl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine
CID 105445512
6-butyl-1-cyclohexyl-5,6-dihydro-4H-cyclopenta[d]pyrazole
CID 129024480
1-cyclobutyl-4,5,6,7-tetrahydroindazol-5-amine
CID 171921881
(4S)-1-cyclohexyl-N-methyl-5,6-dihydro-4H-cyclopenta[d]pyrazol-4-amine
CID 97181762
(4R,4'aS,5R)-1'-cyclopentyl-4,5-bis(ethenyl)-4'a-methylspiro[1,3-dioxolane-2,5'-4,6,7,8-tetrahydrobenzo[f]indazole]
CID 11383004
6-chloro-1-cyclopentyl-4,7-dihydropyrazolo[5,4-d]pyrimidine
CID 136921557
4,5-dibromo-1-cyclopentylpyrazole
CID 115053117
2-(1-cyclopentyl-5-methylpyrazol-4-yl)acetic acid
CID 83883737
1-cyclohexyl-4,5,6,7-tetrahydroindazol-4-amine
CID 65356733
2-cyclopentyl-N-propan-2-ylpyrazol-3-amine
CID 130683846
5-chloro-1-cycloheptylpyrazole
CID 83241860
4-tert-butyl-1-cyclohexyl-5-(trifluoromethyl)pyrazole
CID 58504365

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-6,6-dimethyl-4,5-dihydrocyclopenta[d]pyrazole?
The IUPAC name of 1-cyclohexyl-6,6-dimethyl-4,5-dihydrocyclopenta[d]pyrazole (CID 129024686) is 1-cyclohexyl-6,6-dimethyl-4,5-dihydrocyclopenta[d]pyrazole.
What is the SMILES notation for 1-cyclohexyl-6,6-dimethyl-4,5-dihydrocyclopenta[d]pyrazole?
The canonical SMILES for 1-cyclohexyl-6,6-dimethyl-4,5-dihydrocyclopenta[d]pyrazole is CC1(C)CCc2cnn(C3CCCCC3)c21.
What is the InChIKey of 1-cyclohexyl-6,6-dimethyl-4,5-dihydrocyclopenta[d]pyrazole?
The InChIKey is JEAGPNGMRHSONW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-14(2)9-8-11-10-15-16(13(11)14)12-6-4-3-5-7-12/h10,12H,3-9H2,1-2H3.
What are the key properties of 1-cyclohexyl-6,6-dimethyl-4,5-dihydrocyclopenta[d]pyrazole?
1-cyclohexyl-6,6-dimethyl-4,5-dihydrocyclopenta[d]pyrazole has a molecular weight of 218.34 g/mol, XLogP of 3.61, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-6,6-dimethyl-4,5-dihydrocyclopenta[d]pyrazole is sourced from PubChem (CID 129024686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).