2-(4-bromophenyl)-1-ethylcyclopropan-1-amine

C11H14BrN — CID 84701862

IUPAC2-(4-bromophenyl)-1-ethylcyclopropan-1-amine
SMILESCCC1(N)CC1c1ccc(Br)cc1
InChIInChI=1S/C11H14BrN/c1-2-11(13)7-10(11)8-3-5-9(12)6-4-8/h3-6,10H,2,7,13H2,1H3
InChIKeyKTGNPKLCQXMRCO-UHFFFAOYSA-N
MW240.14 g/mol
LogP3.04
Rot. Bonds2

About 2-(4-bromophenyl)-1-ethylcyclopropan-1-amine

2-(4-bromophenyl)-1-ethylcyclopropan-1-amine (PubChem CID 84701862) has the molecular formula C11H14BrN and a molecular weight of 240.14 g/mol. Its IUPAC name is 2-(4-bromophenyl)-1-ethylcyclopropan-1-amine.

Molecular Properties

Compound Name2-(4-bromophenyl)-1-ethylcyclopropan-1-amine
PubChem CID84701862
Molecular FormulaC11H14BrN
Molecular Weight240.14 g/mol
Exact Mass239.03
IUPAC Name2-(4-bromophenyl)-1-ethylcyclopropan-1-amine
SMILESCCC1(N)CC1c1ccc(Br)cc1
InChIInChI=1S/C11H14BrN/c1-2-11(13)7-10(11)8-3-5-9(12)6-4-8/h3-6,10H,2,7,13H2,1H3
InChIKeyKTGNPKLCQXMRCO-UHFFFAOYSA-N
XLogP3.04
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.14
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-(4-bromophenyl)-1-ethylcyclopropan-1-amine 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

cis-(1R,2S)-2-(3-bromophenyl)-1-ethylcyclopropan-1-amine
CID 90206358
cis-(1R,2S)-1-ethyl-2-[4-(trifluoromethyl)phenyl]cyclopropan-1-amine
CID 90212559
cis-(1S,2R)-2-(4-bromo-3-fluorophenyl)-1-ethylcyclopropan-1-amine
CID 118732679
trans-(1R,2R)-1-ethyl-2-[4-(trifluoromethoxy)phenyl]cyclopropan-1-amine;hydrochloride
CID 118483897
trans-(1R,2R)-2-(2-bromophenyl)-1-ethylcyclopropan-1-amine;hydrochloride
CID 90197933
1-ethyl-2-(3-methylphenyl)cyclopropan-1-amine
CID 84655385
2-(4-bromophenyl)-1-(naphthalen-2-ylmethyl)cyclopropan-1-amine;hydrochloride
CID 90198033
(4S)-4-(4-bromophenyl)-3,3-diethylpyrrolidine
CID 125450649
1-ethyl-2-(3-methoxyphenyl)cyclopropan-1-amine;hydrochloride
CID 90198014
cis-(1R,2S)-2-(2-chlorophenyl)-1-ethylcyclopropan-1-amine
CID 90212874
cis-(1R,2R)-2-(4-bromophenyl)-1-phenylcyclopropan-1-amine;hydrochloride
CID 118483768
N-[4-[(1S,2S)-2-amino-2-ethylcyclopropyl]phenyl]-2-naphthalen-1-ylacetamide
CID 90204678

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-1-ethylcyclopropan-1-amine?
The IUPAC name of 2-(4-bromophenyl)-1-ethylcyclopropan-1-amine (CID 84701862) is 2-(4-bromophenyl)-1-ethylcyclopropan-1-amine.
What is the SMILES notation for 2-(4-bromophenyl)-1-ethylcyclopropan-1-amine?
The canonical SMILES for 2-(4-bromophenyl)-1-ethylcyclopropan-1-amine is CCC1(N)CC1c1ccc(Br)cc1.
What is the InChIKey of 2-(4-bromophenyl)-1-ethylcyclopropan-1-amine?
The InChIKey is KTGNPKLCQXMRCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrN/c1-2-11(13)7-10(11)8-3-5-9(12)6-4-8/h3-6,10H,2,7,13H2,1H3.
What are the key properties of 2-(4-bromophenyl)-1-ethylcyclopropan-1-amine?
2-(4-bromophenyl)-1-ethylcyclopropan-1-amine has a molecular weight of 240.14 g/mol, XLogP of 3.04, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-1-ethylcyclopropan-1-amine is sourced from PubChem (CID 84701862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).