1-(2-aminoethyl)-4-phenylcyclohexan-1-ol

C14H21NO — CID 79127234

IUPAC1-(2-aminoethyl)-4-phenylcyclohexan-1-ol
SMILESNCCC1(O)CCC(c2ccccc2)CC1
InChIInChI=1S/C14H21NO/c15-11-10-14(16)8-6-13(7-9-14)12-4-2-1-3-5-12/h1-5,13,16H,6-11,15H2
InChIKeyWIPJXEKFPVCTLP-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.42
Rot. Bonds3

About 1-(2-aminoethyl)-4-phenylcyclohexan-1-ol

1-(2-aminoethyl)-4-phenylcyclohexan-1-ol (PubChem CID 79127234) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 1-(2-aminoethyl)-4-phenylcyclohexan-1-ol.

Molecular Properties

Compound Name1-(2-aminoethyl)-4-phenylcyclohexan-1-ol
PubChem CID79127234
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name1-(2-aminoethyl)-4-phenylcyclohexan-1-ol
SMILESNCCC1(O)CCC(c2ccccc2)CC1
InChIInChI=1S/C14H21NO/c15-11-10-14(16)8-6-13(7-9-14)12-4-2-1-3-5-12/h1-5,13,16H,6-11,15H2
InChIKeyWIPJXEKFPVCTLP-UHFFFAOYSA-N
XLogP2.42
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(methylaminomethyl)-4-phenylcyclohexan-1-ol
CID 62774871
6-phenylspiro[2.5]octane
CID 123640963
N-(4-fluorophenyl)-2-(1-hydroxy-4-phenylcyclohexyl)acetamide
CID 121324975
[(1S,3R)-1-amino-3-phenylcyclopentyl]methanol
CID 67361364
1-(aminomethyl)-4-pyridin-3-ylcyclohexan-1-ol
CID 82283334
1-(aminomethyl)-N-methyl-4-phenylcyclohexan-1-amine
CID 62066369
benzene;cyclopropylbenzene
CID 144638417
4-phenyl-1-[(E)-4-phenylbut-1-enyl]cyclohexan-1-ol
CID 16664434
4-phenyl-1-thiophen-3-ylcyclohexan-1-ol
CID 65099659
(1-anilino-4-phenylcyclohexyl)methanol
CID 61046248
2-(1-methyl-4-phenylcyclohexyl)acetic acid
CID 169408960
1-(4-chlorophenyl)-4-phenylcyclohexan-1-amine
CID 63407795

Frequently Asked Questions

What is the IUPAC name of 1-(2-aminoethyl)-4-phenylcyclohexan-1-ol?
The IUPAC name of 1-(2-aminoethyl)-4-phenylcyclohexan-1-ol (CID 79127234) is 1-(2-aminoethyl)-4-phenylcyclohexan-1-ol.
What is the SMILES notation for 1-(2-aminoethyl)-4-phenylcyclohexan-1-ol?
The canonical SMILES for 1-(2-aminoethyl)-4-phenylcyclohexan-1-ol is NCCC1(O)CCC(c2ccccc2)CC1.
What is the InChIKey of 1-(2-aminoethyl)-4-phenylcyclohexan-1-ol?
The InChIKey is WIPJXEKFPVCTLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c15-11-10-14(16)8-6-13(7-9-14)12-4-2-1-3-5-12/h1-5,13,16H,6-11,15H2.
What are the key properties of 1-(2-aminoethyl)-4-phenylcyclohexan-1-ol?
1-(2-aminoethyl)-4-phenylcyclohexan-1-ol has a molecular weight of 219.33 g/mol, XLogP of 2.42, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminoethyl)-4-phenylcyclohexan-1-ol is sourced from PubChem (CID 79127234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).