1,2-dimethyl-2-(prop-2-enylamino)cyclopentan-1-ol

C10H19NO — CID 130673524

IUPAC1,2-dimethyl-2-(prop-2-enylamino)cyclopentan-1-ol
SMILESC=CCNC1(C)CCCC1(C)O
InChIInChI=1S/C10H19NO/c1-4-8-11-9(2)6-5-7-10(9,3)12/h4,11-12H,1,5-8H2,2-3H3
InChIKeyAFGUPCGRAJRVMN-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.46
Rot. Bonds3

About 1,2-dimethyl-2-(prop-2-enylamino)cyclopentan-1-ol

1,2-dimethyl-2-(prop-2-enylamino)cyclopentan-1-ol (PubChem CID 130673524) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 1,2-dimethyl-2-(prop-2-enylamino)cyclopentan-1-ol.

Molecular Properties

Compound Name1,2-dimethyl-2-(prop-2-enylamino)cyclopentan-1-ol
PubChem CID130673524
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name1,2-dimethyl-2-(prop-2-enylamino)cyclopentan-1-ol
SMILESC=CCNC1(C)CCCC1(C)O
InChIInChI=1S/C10H19NO/c1-4-8-11-9(2)6-5-7-10(9,3)12/h4,11-12H,1,5-8H2,2-3H3
InChIKeyAFGUPCGRAJRVMN-UHFFFAOYSA-N
XLogP1.46
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.46
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 1,2-dimethyl-2-(prop-2-enylamino)cyclopentan-1-ol?
The IUPAC name of 1,2-dimethyl-2-(prop-2-enylamino)cyclopentan-1-ol (CID 130673524) is 1,2-dimethyl-2-(prop-2-enylamino)cyclopentan-1-ol.
What is the SMILES notation for 1,2-dimethyl-2-(prop-2-enylamino)cyclopentan-1-ol?
The canonical SMILES for 1,2-dimethyl-2-(prop-2-enylamino)cyclopentan-1-ol is C=CCNC1(C)CCCC1(C)O.
What is the InChIKey of 1,2-dimethyl-2-(prop-2-enylamino)cyclopentan-1-ol?
The InChIKey is AFGUPCGRAJRVMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-4-8-11-9(2)6-5-7-10(9,3)12/h4,11-12H,1,5-8H2,2-3H3.
What are the key properties of 1,2-dimethyl-2-(prop-2-enylamino)cyclopentan-1-ol?
1,2-dimethyl-2-(prop-2-enylamino)cyclopentan-1-ol has a molecular weight of 169.27 g/mol, XLogP of 1.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-2-(prop-2-enylamino)cyclopentan-1-ol is sourced from PubChem (CID 130673524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).