benzene;2-[(2R)-2-cyclohexylpyrrolidin-1-yl]ethanol

C18H29NO — CID 143494141

IUPACbenzene;2-[(2R)-2-cyclohexylpyrrolidin-1-yl]ethanol
SMILESOCCN1CCC[C@@H]1C1CCCCC1.c1ccccc1
InChIInChI=1S/C12H23NO.C6H6/c14-10-9-13-8-4-7-12(13)11-5-2-1-3-6-11;1-2-4-6-5-3-1/h11-12,14H,1-10H2;1-6H/t12-;/m1./s1
InChIKeyDODWWKKHZIKCJH-UTONKHPSSA-N
MW275.44 g/mol
LogP3.71
Rot. Bonds3

About benzene;2-[(2R)-2-cyclohexylpyrrolidin-1-yl]ethanol

benzene;2-[(2R)-2-cyclohexylpyrrolidin-1-yl]ethanol (PubChem CID 143494141) has the molecular formula C18H29NO and a molecular weight of 275.44 g/mol. Its IUPAC name is benzene;2-[(2R)-2-cyclohexylpyrrolidin-1-yl]ethanol.

Molecular Properties

Compound Namebenzene;2-[(2R)-2-cyclohexylpyrrolidin-1-yl]ethanol
PubChem CID143494141
Molecular FormulaC18H29NO
Molecular Weight275.44 g/mol
Exact Mass275.22
IUPAC Namebenzene;2-[(2R)-2-cyclohexylpyrrolidin-1-yl]ethanol
SMILESOCCN1CCC[C@@H]1C1CCCCC1.c1ccccc1
InChIInChI=1S/C12H23NO.C6H6/c14-10-9-13-8-4-7-12(13)11-5-2-1-3-6-11;1-2-4-6-5-3-1/h11-12,14H,1-10H2;1-6H/t12-;/m1./s1
InChIKeyDODWWKKHZIKCJH-UTONKHPSSA-N
XLogP3.71
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze benzene;2-[(2R)-2-cyclohexylpyrrolidin-1-yl]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)propan-1-ol
CID 65319985
3-[(2S)-2-cyclohexylpyrrolidin-1-yl]propanoic acid
CID 42576565
2-[2-(2-cycloheptylazepan-1-yl)ethoxy]ethanol
CID 152713199
3-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-1-phenylpropan-1-ol
CID 62613754
3-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-1-phenylpropan-1-one
CID 62613737
2-cyclopentyl-1-(2-phenylsulfanylethyl)pyrrolidine
CID 79315744
[1-[[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]methyl]cycloheptyl]methanol
CID 102728342
2-[2-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)ethyl]cyclopentan-1-ol
CID 79564172
3-(3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-yl)propan-1-ol
CID 130620337
2-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)acetic acid
CID 43409735
2-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ylmethyl)cycloheptan-1-ol
CID 65324416
2-[[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]methyl]prop-2-enoic acid
CID 102727093

Frequently Asked Questions

What is the IUPAC name of benzene;2-[(2R)-2-cyclohexylpyrrolidin-1-yl]ethanol?
The IUPAC name of benzene;2-[(2R)-2-cyclohexylpyrrolidin-1-yl]ethanol (CID 143494141) is benzene;2-[(2R)-2-cyclohexylpyrrolidin-1-yl]ethanol.
What is the SMILES notation for benzene;2-[(2R)-2-cyclohexylpyrrolidin-1-yl]ethanol?
The canonical SMILES for benzene;2-[(2R)-2-cyclohexylpyrrolidin-1-yl]ethanol is OCCN1CCC[C@@H]1C1CCCCC1.c1ccccc1.
What is the InChIKey of benzene;2-[(2R)-2-cyclohexylpyrrolidin-1-yl]ethanol?
The InChIKey is DODWWKKHZIKCJH-UTONKHPSSA-N. The full InChI is InChI=1S/C12H23NO.C6H6/c14-10-9-13-8-4-7-12(13)11-5-2-1-3-6-11;1-2-4-6-5-3-1/h11-12,14H,1-10H2;1-6H/t12-;/m1./s1.
What are the key properties of benzene;2-[(2R)-2-cyclohexylpyrrolidin-1-yl]ethanol?
benzene;2-[(2R)-2-cyclohexylpyrrolidin-1-yl]ethanol has a molecular weight of 275.44 g/mol, XLogP of 3.71, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;2-[(2R)-2-cyclohexylpyrrolidin-1-yl]ethanol is sourced from PubChem (CID 143494141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).