2-(cyclopent-2-en-1-ylamino)-1,2-dimethylcyclopentan-1-ol

C12H21NO — CID 164645448

IUPAC2-(cyclopent-2-en-1-ylamino)-1,2-dimethylcyclopentan-1-ol
SMILESCC1(O)CCCC1(C)NC1C=CCC1
InChIInChI=1S/C12H21NO/c1-11(8-5-9-12(11,2)14)13-10-6-3-4-7-10/h3,6,10,13-14H,4-5,7-9H2,1-2H3
InChIKeyGCDZTJVPPZCDAD-UHFFFAOYSA-N
MW195.31 g/mol
LogP1.99
Rot. Bonds2

About 2-(cyclopent-2-en-1-ylamino)-1,2-dimethylcyclopentan-1-ol

2-(cyclopent-2-en-1-ylamino)-1,2-dimethylcyclopentan-1-ol (PubChem CID 164645448) has the molecular formula C12H21NO and a molecular weight of 195.31 g/mol. Its IUPAC name is 2-(cyclopent-2-en-1-ylamino)-1,2-dimethylcyclopentan-1-ol.

Molecular Properties

Compound Name2-(cyclopent-2-en-1-ylamino)-1,2-dimethylcyclopentan-1-ol
PubChem CID164645448
Molecular FormulaC12H21NO
Molecular Weight195.31 g/mol
Exact Mass195.16
IUPAC Name2-(cyclopent-2-en-1-ylamino)-1,2-dimethylcyclopentan-1-ol
SMILESCC1(O)CCCC1(C)NC1C=CCC1
InChIInChI=1S/C12H21NO/c1-11(8-5-9-12(11,2)14)13-10-6-3-4-7-10/h3,6,10,13-14H,4-5,7-9H2,1-2H3
InChIKeyGCDZTJVPPZCDAD-UHFFFAOYSA-N
XLogP1.99
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopent-2-en-1-ylamino)-1,2-dimethylcyclopentan-1-ol?
The IUPAC name of 2-(cyclopent-2-en-1-ylamino)-1,2-dimethylcyclopentan-1-ol (CID 164645448) is 2-(cyclopent-2-en-1-ylamino)-1,2-dimethylcyclopentan-1-ol.
What is the SMILES notation for 2-(cyclopent-2-en-1-ylamino)-1,2-dimethylcyclopentan-1-ol?
The canonical SMILES for 2-(cyclopent-2-en-1-ylamino)-1,2-dimethylcyclopentan-1-ol is CC1(O)CCCC1(C)NC1C=CCC1.
What is the InChIKey of 2-(cyclopent-2-en-1-ylamino)-1,2-dimethylcyclopentan-1-ol?
The InChIKey is GCDZTJVPPZCDAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO/c1-11(8-5-9-12(11,2)14)13-10-6-3-4-7-10/h3,6,10,13-14H,4-5,7-9H2,1-2H3.
What are the key properties of 2-(cyclopent-2-en-1-ylamino)-1,2-dimethylcyclopentan-1-ol?
2-(cyclopent-2-en-1-ylamino)-1,2-dimethylcyclopentan-1-ol has a molecular weight of 195.31 g/mol, XLogP of 1.99, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopent-2-en-1-ylamino)-1,2-dimethylcyclopentan-1-ol is sourced from PubChem (CID 164645448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).