2-[4-[2-(1-aminocyclopropyl)ethyl]phenyl]ethanol

C13H19NO — CID 105457995

IUPAC2-[4-[2-(1-aminocyclopropyl)ethyl]phenyl]ethanol
SMILESNC1(CCc2ccc(CCO)cc2)CC1
InChIInChI=1S/C13H19NO/c14-13(8-9-13)7-5-11-1-3-12(4-2-11)6-10-15/h1-4,15H,5-10,14H2
InChIKeyYCTLJRRPGPJQER-UHFFFAOYSA-N
MW205.30 g/mol
LogP1.65
Rot. Bonds5

About 2-[4-[2-(1-aminocyclopropyl)ethyl]phenyl]ethanol

2-[4-[2-(1-aminocyclopropyl)ethyl]phenyl]ethanol (PubChem CID 105457995) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 2-[4-[2-(1-aminocyclopropyl)ethyl]phenyl]ethanol.

Molecular Properties

Compound Name2-[4-[2-(1-aminocyclopropyl)ethyl]phenyl]ethanol
PubChem CID105457995
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name2-[4-[2-(1-aminocyclopropyl)ethyl]phenyl]ethanol
SMILESNC1(CCc2ccc(CCO)cc2)CC1
InChIInChI=1S/C13H19NO/c14-13(8-9-13)7-5-11-1-3-12(4-2-11)6-10-15/h1-4,15H,5-10,14H2
InChIKeyYCTLJRRPGPJQER-UHFFFAOYSA-N
XLogP1.65
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[4-[2-(1-aminocyclopropyl)ethyl]phenyl]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

[4-[2-(1-aminocyclopropyl)ethyl]phenyl]methanol
CID 105445343
2-[4-[(1-aminocyclopropyl)methyl]phenyl]ethanol
CID 117116056
1-[2-(4-fluorophenyl)ethyl]cyclopropan-1-amine
CID 67420694
1-[2-[4-(methoxymethyl)phenyl]ethyl]cyclopropan-1-amine
CID 105457986
2-[4-(1-aminocyclobutyl)phenyl]ethanol
CID 117112872
1-[2-(4-bromophenyl)ethyl]cyclobutan-1-amine
CID 115074168
1-[2-(3,4-dimethylphenyl)ethyl]cyclopropan-1-amine
CID 83684647
[4-[2-(1-aminocyclopropyl)ethyl]-2-pyridinyl]methanol
CID 105446398
1-(2-naphthalen-2-ylethyl)cyclopropan-1-amine
CID 23106122
1-(2-thiophen-3-ylethyl)cyclopropan-1-amine
CID 66025535
1-[3-(4-bromophenyl)propyl]cyclopropan-1-amine
CID 83913067
1-[3-(4-methylphenyl)propyl]cyclopropan-1-amine
CID 83907225

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-(1-aminocyclopropyl)ethyl]phenyl]ethanol?
The IUPAC name of 2-[4-[2-(1-aminocyclopropyl)ethyl]phenyl]ethanol (CID 105457995) is 2-[4-[2-(1-aminocyclopropyl)ethyl]phenyl]ethanol.
What is the SMILES notation for 2-[4-[2-(1-aminocyclopropyl)ethyl]phenyl]ethanol?
The canonical SMILES for 2-[4-[2-(1-aminocyclopropyl)ethyl]phenyl]ethanol is NC1(CCc2ccc(CCO)cc2)CC1.
What is the InChIKey of 2-[4-[2-(1-aminocyclopropyl)ethyl]phenyl]ethanol?
The InChIKey is YCTLJRRPGPJQER-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c14-13(8-9-13)7-5-11-1-3-12(4-2-11)6-10-15/h1-4,15H,5-10,14H2.
What are the key properties of 2-[4-[2-(1-aminocyclopropyl)ethyl]phenyl]ethanol?
2-[4-[2-(1-aminocyclopropyl)ethyl]phenyl]ethanol has a molecular weight of 205.30 g/mol, XLogP of 1.65, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-(1-aminocyclopropyl)ethyl]phenyl]ethanol is sourced from PubChem (CID 105457995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).