4-[2-[(4-ethylcyclohexyl)amino]ethyl]phenol

C16H25NO — CID 61238876

IUPAC4-[2-[(4-ethylcyclohexyl)amino]ethyl]phenol
SMILESCCC1CCC(NCCc2ccc(O)cc2)CC1
InChIInChI=1S/C16H25NO/c1-2-13-3-7-15(8-4-13)17-12-11-14-5-9-16(18)10-6-14/h5-6,9-10,13,15,17-18H,2-4,7-8,11-12H2,1H3
InChIKeyBMEIGOMARYATEL-UHFFFAOYSA-N
MW247.38 g/mol
LogP3.49
Rot. Bonds5

About 4-[2-[(4-ethylcyclohexyl)amino]ethyl]phenol

4-[2-[(4-ethylcyclohexyl)amino]ethyl]phenol (PubChem CID 61238876) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is 4-[2-[(4-ethylcyclohexyl)amino]ethyl]phenol.

Molecular Properties

Compound Name4-[2-[(4-ethylcyclohexyl)amino]ethyl]phenol
PubChem CID61238876
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC Name4-[2-[(4-ethylcyclohexyl)amino]ethyl]phenol
SMILESCCC1CCC(NCCc2ccc(O)cc2)CC1
InChIInChI=1S/C16H25NO/c1-2-13-3-7-15(8-4-13)17-12-11-14-5-9-16(18)10-6-14/h5-6,9-10,13,15,17-18H,2-4,7-8,11-12H2,1H3
InChIKeyBMEIGOMARYATEL-UHFFFAOYSA-N
XLogP3.49
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-[2-[(4-ethylcyclohexyl)amino]ethyl]phenol 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

4-[2-(cyclooctylamino)ethyl]phenol
CID 61238875
4-[2-[(4-tert-butylcyclohexyl)amino]ethyl]phenol
CID 61239240
4-[2-[(1-ethylpiperidin-4-yl)amino]ethyl]phenol
CID 61239241
N-[2-(4-ethylphenyl)ethyl]cyclopropanamine
CID 62550255
3-ethyl-N-(2-phenylethyl)cyclopentan-1-amine
CID 64500794
N-[2-[4-(diethylaminomethyl)phenyl]ethyl]cyclopropanamine
CID 105346462
4-[[(4-propylcyclohexyl)amino]methyl]phenol
CID 54962641
4-[2-(1,4-dioxaspiro[4.5]decan-8-ylamino)ethyl]phenol
CID 61238378
4-[2-[[(1S,2R)-2-hydroxycyclohexyl]amino]ethyl]phenol
CID 129394205
N-[2-(4-butan-2-ylphenyl)ethyl]cyclopropanamine
CID 82262237
4-ethyl-N-[(4-methylphenyl)methyl]cyclohexan-1-amine
CID 43078853
4-[[[4-(hydroxymethyl)cyclohexyl]amino]methyl]phenol
CID 112753322

Frequently Asked Questions

What is the IUPAC name of 4-[2-[(4-ethylcyclohexyl)amino]ethyl]phenol?
The IUPAC name of 4-[2-[(4-ethylcyclohexyl)amino]ethyl]phenol (CID 61238876) is 4-[2-[(4-ethylcyclohexyl)amino]ethyl]phenol.
What is the SMILES notation for 4-[2-[(4-ethylcyclohexyl)amino]ethyl]phenol?
The canonical SMILES for 4-[2-[(4-ethylcyclohexyl)amino]ethyl]phenol is CCC1CCC(NCCc2ccc(O)cc2)CC1.
What is the InChIKey of 4-[2-[(4-ethylcyclohexyl)amino]ethyl]phenol?
The InChIKey is BMEIGOMARYATEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-2-13-3-7-15(8-4-13)17-12-11-14-5-9-16(18)10-6-14/h5-6,9-10,13,15,17-18H,2-4,7-8,11-12H2,1H3.
What are the key properties of 4-[2-[(4-ethylcyclohexyl)amino]ethyl]phenol?
4-[2-[(4-ethylcyclohexyl)amino]ethyl]phenol has a molecular weight of 247.38 g/mol, XLogP of 3.49, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[(4-ethylcyclohexyl)amino]ethyl]phenol is sourced from PubChem (CID 61238876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).