1-(2-cyclopropylphenyl)-2-(propan-2-ylamino)ethanol

C14H21NO — CID 79982949

IUPAC1-(2-cyclopropylphenyl)-2-(propan-2-ylamino)ethanol
SMILESCC(C)NCC(O)c1ccccc1C1CC1
InChIInChI=1S/C14H21NO/c1-10(2)15-9-14(16)13-6-4-3-5-12(13)11-7-8-11/h3-6,10-11,14-16H,7-9H2,1-2H3
InChIKeyBQNJYPXBJMDMQY-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.60
Rot. Bonds5

About 1-(2-cyclopropylphenyl)-2-(propan-2-ylamino)ethanol

1-(2-cyclopropylphenyl)-2-(propan-2-ylamino)ethanol (PubChem CID 79982949) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 1-(2-cyclopropylphenyl)-2-(propan-2-ylamino)ethanol.

Molecular Properties

Compound Name1-(2-cyclopropylphenyl)-2-(propan-2-ylamino)ethanol
PubChem CID79982949
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name1-(2-cyclopropylphenyl)-2-(propan-2-ylamino)ethanol
SMILESCC(C)NCC(O)c1ccccc1C1CC1
InChIInChI=1S/C14H21NO/c1-10(2)15-9-14(16)13-6-4-3-5-12(13)11-7-8-11/h3-6,10-11,14-16H,7-9H2,1-2H3
InChIKeyBQNJYPXBJMDMQY-UHFFFAOYSA-N
XLogP2.60
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(2-cyclopropylphenyl)-2-(propan-2-ylamino)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

1-(2-cyclopropylphenyl)-2-phenylethanol
CID 79983635
3-amino-1-(2-cyclopropylphenyl)propan-1-ol
CID 79982961
2-amino-1-(2-cyclohexylphenyl)ethanol
CID 83837309
(1S)-1-(2-chlorophenyl)-2-(propan-2-ylamino)ethanol;hydrochloride
CID 76957004
3-(2-cyclopropylphenyl)-3-hydroxypropanal
CID 114795310
2-(propan-2-ylamino)-1-(2-propan-2-yloxyphenyl)ethanol
CID 79023945
2-(2-cyclopropylphenyl)-2-(2-methylpropylamino)acetamide
CID 79982650
1-(2-cyclopropylphenyl)-2-(2,4,6-trimethylphenyl)ethanol
CID 79970895
sodium;1-(2-chlorophenyl)-2-(propan-2-ylamino)ethanol;hydride;hydrate;hydrochloride
CID 173081164
2-(2-cyclopropylphenyl)-2-(ethylamino)ethanol
CID 79983481
(2-cyclopropylphenyl)-(4-propan-2-ylphenyl)methanol
CID 79983378
1-(2-cyclobutylphenyl)-3-phenylpropan-1-ol
CID 114601312

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclopropylphenyl)-2-(propan-2-ylamino)ethanol?
The IUPAC name of 1-(2-cyclopropylphenyl)-2-(propan-2-ylamino)ethanol (CID 79982949) is 1-(2-cyclopropylphenyl)-2-(propan-2-ylamino)ethanol.
What is the SMILES notation for 1-(2-cyclopropylphenyl)-2-(propan-2-ylamino)ethanol?
The canonical SMILES for 1-(2-cyclopropylphenyl)-2-(propan-2-ylamino)ethanol is CC(C)NCC(O)c1ccccc1C1CC1.
What is the InChIKey of 1-(2-cyclopropylphenyl)-2-(propan-2-ylamino)ethanol?
The InChIKey is BQNJYPXBJMDMQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-10(2)15-9-14(16)13-6-4-3-5-12(13)11-7-8-11/h3-6,10-11,14-16H,7-9H2,1-2H3.
What are the key properties of 1-(2-cyclopropylphenyl)-2-(propan-2-ylamino)ethanol?
1-(2-cyclopropylphenyl)-2-(propan-2-ylamino)ethanol has a molecular weight of 219.33 g/mol, XLogP of 2.60, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopropylphenyl)-2-(propan-2-ylamino)ethanol is sourced from PubChem (CID 79982949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).