4-[cyclohexyl(ethyl)amino]pyrrolidin-3-ol

C12H24N2O — CID 63703140

IUPAC4-[cyclohexyl(ethyl)amino]pyrrolidin-3-ol
SMILESCCN(C1CCCCC1)C1CNCC1O
InChIInChI=1S/C12H24N2O/c1-2-14(10-6-4-3-5-7-10)11-8-13-9-12(11)15/h10-13,15H,2-9H2,1H3
InChIKeyYMHDTJOGMYOQGA-UHFFFAOYSA-N
MW212.34 g/mol
LogP0.97
Rot. Bonds3

About 4-[cyclohexyl(ethyl)amino]pyrrolidin-3-ol

4-[cyclohexyl(ethyl)amino]pyrrolidin-3-ol (PubChem CID 63703140) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 4-[cyclohexyl(ethyl)amino]pyrrolidin-3-ol.

Molecular Properties

Compound Name4-[cyclohexyl(ethyl)amino]pyrrolidin-3-ol
PubChem CID63703140
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name4-[cyclohexyl(ethyl)amino]pyrrolidin-3-ol
SMILESCCN(C1CCCCC1)C1CNCC1O
InChIInChI=1S/C12H24N2O/c1-2-14(10-6-4-3-5-7-10)11-8-13-9-12(11)15/h10-13,15H,2-9H2,1H3
InChIKeyYMHDTJOGMYOQGA-UHFFFAOYSA-N
XLogP0.97
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3R,4R)-4-[cyclopentyl(ethyl)amino]pyrrolidin-3-ol;hydrochloride
CID 130905232
N-cyclohexyl-N-ethyl-5-methylpiperidin-3-amine
CID 115373345
(3S,4R)-4-(diethylamino)pyrrolidin-3-ol
CID 129371186
N-cyclohexyl-N-ethylpyrrolidin-3-amine;dihydrochloride
CID 56831616
N-cyclohexyl-N-ethylpyrrolidin-3-amine;hydrochloride
CID 156593457
N-cyclohexyl-N-propylazetidin-3-amine
CID 66183284
1-N-cyclopentyl-1-N-ethylcycloheptane-1,2-diamine
CID 43541082
N-cyclohexyl-N-ethylazepan-4-amine
CID 63904813
N-ethyl-N-(2-ethylcyclohexyl)azetidin-3-amine
CID 66182710
2-[cyclohexyl(ethyl)amino]cyclobutane-1-carboxylic acid
CID 80997243
2-N-cyclopentyl-2-N-ethylcyclohexane-1,2-diamine
CID 43541047
N-ethyl-N-(4-methylcycloheptyl)azetidin-3-amine
CID 66181660

Frequently Asked Questions

What is the IUPAC name of 4-[cyclohexyl(ethyl)amino]pyrrolidin-3-ol?
The IUPAC name of 4-[cyclohexyl(ethyl)amino]pyrrolidin-3-ol (CID 63703140) is 4-[cyclohexyl(ethyl)amino]pyrrolidin-3-ol.
What is the SMILES notation for 4-[cyclohexyl(ethyl)amino]pyrrolidin-3-ol?
The canonical SMILES for 4-[cyclohexyl(ethyl)amino]pyrrolidin-3-ol is CCN(C1CCCCC1)C1CNCC1O.
What is the InChIKey of 4-[cyclohexyl(ethyl)amino]pyrrolidin-3-ol?
The InChIKey is YMHDTJOGMYOQGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-2-14(10-6-4-3-5-7-10)11-8-13-9-12(11)15/h10-13,15H,2-9H2,1H3.
What are the key properties of 4-[cyclohexyl(ethyl)amino]pyrrolidin-3-ol?
4-[cyclohexyl(ethyl)amino]pyrrolidin-3-ol has a molecular weight of 212.34 g/mol, XLogP of 0.97, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[cyclohexyl(ethyl)amino]pyrrolidin-3-ol is sourced from PubChem (CID 63703140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).