2-amino-4-(3-methyl-5-propan-2-ylpyrazol-1-yl)cyclopentan-1-ol

C12H21N3O — CID 122630987

IUPAC2-amino-4-(3-methyl-5-propan-2-ylpyrazol-1-yl)cyclopentan-1-ol
SMILESCc1cc(C(C)C)n(C2CC(N)C(O)C2)n1
InChIInChI=1S/C12H21N3O/c1-7(2)11-4-8(3)14-15(11)9-5-10(13)12(16)6-9/h4,7,9-10,12,16H,5-6,13H2,1-3H3
InChIKeyUKNPNSWFWCMWHR-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.34
Rot. Bonds2

About 2-amino-4-(3-methyl-5-propan-2-ylpyrazol-1-yl)cyclopentan-1-ol

2-amino-4-(3-methyl-5-propan-2-ylpyrazol-1-yl)cyclopentan-1-ol (PubChem CID 122630987) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is 2-amino-4-(3-methyl-5-propan-2-ylpyrazol-1-yl)cyclopentan-1-ol.

Molecular Properties

Compound Name2-amino-4-(3-methyl-5-propan-2-ylpyrazol-1-yl)cyclopentan-1-ol
PubChem CID122630987
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name2-amino-4-(3-methyl-5-propan-2-ylpyrazol-1-yl)cyclopentan-1-ol
SMILESCc1cc(C(C)C)n(C2CC(N)C(O)C2)n1
InChIInChI=1S/C12H21N3O/c1-7(2)11-4-8(3)14-15(11)9-5-10(13)12(16)6-9/h4,7,9-10,12,16H,5-6,13H2,1-3H3
InChIKeyUKNPNSWFWCMWHR-UHFFFAOYSA-N
XLogP1.34
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

trans-(1S,2S)-2-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]cyclopentan-1-ol
CID 164632416
4-[5-Propan-2-yl-3-(trifluoromethyl)pyrazol-1-yl]cyclopentane-1,2-diol
CID 134331573
2-Amino-4-[5-propan-2-yl-3-(trifluoromethyl)pyrazol-1-yl]cyclopentan-1-ol
CID 134331594
3-[5-Propan-2-yl-3-(trifluoromethyl)pyrazol-1-yl]cyclopentan-1-ol
CID 134331678
2-Amino-4-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]cyclopentan-1-ol
CID 138654945
trans-(1R,2R)-2-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]cyclopentan-1-ol
CID 138031846
cis-4-(3,5-Diisopropyl-pyrazol-1-yl)-cyclohexanol
CID 58256803
2-(3,5-Dimethylpyrazol-1-yl)cyclopentan-1-ol
CID 60878190
2-(3,5-Ditert-butylpyrazol-1-yl)cyclopentan-1-ol
CID 62714627
2-[(2-Ethyl-5-methylpyrazol-3-yl)methyl]cyclopentan-1-ol
CID 65853539
trans-(1R,2R)-2-(3,5-dimethylpyrazol-1-yl)cyclopentan-1-ol
CID 102735055
trans-(1S,2S)-2-(3,5-dimethylpyrazol-1-yl)cyclopentan-1-ol
CID 102735056

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-(3-methyl-5-propan-2-ylpyrazol-1-yl)cyclopentan-1-ol?
The IUPAC name of 2-amino-4-(3-methyl-5-propan-2-ylpyrazol-1-yl)cyclopentan-1-ol (CID 122630987) is 2-amino-4-(3-methyl-5-propan-2-ylpyrazol-1-yl)cyclopentan-1-ol.
What is the SMILES notation for 2-amino-4-(3-methyl-5-propan-2-ylpyrazol-1-yl)cyclopentan-1-ol?
The canonical SMILES for 2-amino-4-(3-methyl-5-propan-2-ylpyrazol-1-yl)cyclopentan-1-ol is Cc1cc(C(C)C)n(C2CC(N)C(O)C2)n1.
What is the InChIKey of 2-amino-4-(3-methyl-5-propan-2-ylpyrazol-1-yl)cyclopentan-1-ol?
The InChIKey is UKNPNSWFWCMWHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-7(2)11-4-8(3)14-15(11)9-5-10(13)12(16)6-9/h4,7,9-10,12,16H,5-6,13H2,1-3H3.
What are the key properties of 2-amino-4-(3-methyl-5-propan-2-ylpyrazol-1-yl)cyclopentan-1-ol?
2-amino-4-(3-methyl-5-propan-2-ylpyrazol-1-yl)cyclopentan-1-ol has a molecular weight of 223.32 g/mol, XLogP of 1.34, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-(3-methyl-5-propan-2-ylpyrazol-1-yl)cyclopentan-1-ol is sourced from PubChem (CID 122630987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).