3-(cyclohepten-1-yl)-1-cyclopropylpyrrolidin-3-ol

C14H23NO — CID 106650889

IUPAC3-(cyclohepten-1-yl)-1-cyclopropylpyrrolidin-3-ol
SMILESOC1(C2=CCCCCC2)CCN(C2CC2)C1
InChIInChI=1S/C14H23NO/c16-14(12-5-3-1-2-4-6-12)9-10-15(11-14)13-7-8-13/h5,13,16H,1-4,6-11H2
InChIKeyUFQVPLRXVQBEAE-UHFFFAOYSA-N
MW221.34 g/mol
LogP2.48
Rot. Bonds2

About 3-(cyclohepten-1-yl)-1-cyclopropylpyrrolidin-3-ol

3-(cyclohepten-1-yl)-1-cyclopropylpyrrolidin-3-ol (PubChem CID 106650889) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is 3-(cyclohepten-1-yl)-1-cyclopropylpyrrolidin-3-ol.

Molecular Properties

Compound Name3-(cyclohepten-1-yl)-1-cyclopropylpyrrolidin-3-ol
PubChem CID106650889
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name3-(cyclohepten-1-yl)-1-cyclopropylpyrrolidin-3-ol
SMILESOC1(C2=CCCCCC2)CCN(C2CC2)C1
InChIInChI=1S/C14H23NO/c16-14(12-5-3-1-2-4-6-12)9-10-15(11-14)13-7-8-13/h5,13,16H,1-4,6-11H2
InChIKeyUFQVPLRXVQBEAE-UHFFFAOYSA-N
XLogP2.48
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(2-methylprop-1-enyl)-3,5,6,7,8,8a-hexahydro-2H-indolizin-1-ol
CID 81886676
2-[(1R,6R)-9-methyl-9-azabicyclo[4.2.1]non-2-en-2-yl]propan-2-ol
CID 101613769
3-(Cycloocten-1-yl)-1-methylpyrrolidin-3-ol
CID 106650884
3-(Cyclohexen-1-yl)-1-methylpyrrolidin-3-ol
CID 106650885
3-(Cyclohepten-1-yl)-1-methylpyrrolidin-3-ol
CID 106650886
3-(Cycloocten-1-yl)-1-cyclopropylpyrrolidin-3-ol
CID 106650887
3-(Cyclohexen-1-yl)-1-cyclopropylpyrrolidin-3-ol
CID 106650888
3-(Cyclohepten-1-yl)pyrrolidin-3-ol
CID 106650911
3-(Cycloocten-1-yl)-1,5-dimethylpyrrolidin-3-ol
CID 106651396
3-(Cyclohexen-1-yl)-1,5-dimethylpyrrolidin-3-ol
CID 106651397
3-(Cyclohepten-1-yl)-1,5-dimethylpyrrolidin-3-ol
CID 106651398
7-(cyclohepten-1-yl)-2,3,5,6,8,8a-hexahydro-1H-indolizin-7-ol
CID 106651408

Frequently Asked Questions

What is the IUPAC name of 3-(cyclohepten-1-yl)-1-cyclopropylpyrrolidin-3-ol?
The IUPAC name of 3-(cyclohepten-1-yl)-1-cyclopropylpyrrolidin-3-ol (CID 106650889) is 3-(cyclohepten-1-yl)-1-cyclopropylpyrrolidin-3-ol.
What is the SMILES notation for 3-(cyclohepten-1-yl)-1-cyclopropylpyrrolidin-3-ol?
The canonical SMILES for 3-(cyclohepten-1-yl)-1-cyclopropylpyrrolidin-3-ol is OC1(C2=CCCCCC2)CCN(C2CC2)C1.
What is the InChIKey of 3-(cyclohepten-1-yl)-1-cyclopropylpyrrolidin-3-ol?
The InChIKey is UFQVPLRXVQBEAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c16-14(12-5-3-1-2-4-6-12)9-10-15(11-14)13-7-8-13/h5,13,16H,1-4,6-11H2.
What are the key properties of 3-(cyclohepten-1-yl)-1-cyclopropylpyrrolidin-3-ol?
3-(cyclohepten-1-yl)-1-cyclopropylpyrrolidin-3-ol has a molecular weight of 221.34 g/mol, XLogP of 2.48, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclohepten-1-yl)-1-cyclopropylpyrrolidin-3-ol is sourced from PubChem (CID 106650889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).