2-[(E)-2-phenylethenyl]cyclopropan-1-amine;hydrochloride

C11H14ClN — CID 122640919

IUPAC2-[(E)-2-phenylethenyl]cyclopropan-1-amine;hydrochloride
SMILESCl.NC1CC1/C=C/c1ccccc1
InChIInChI=1S/C11H13N.ClH/c12-11-8-10(11)7-6-9-4-2-1-3-5-9;/h1-7,10-11H,8,12H2;1H/b7-6+;
InChIKeyBGDHHIOQHDVJQI-UHDJGPCESA-N
MW195.69 g/mol
LogP2.47
Rot. Bonds2

About 2-[(E)-2-phenylethenyl]cyclopropan-1-amine;hydrochloride

2-[(E)-2-phenylethenyl]cyclopropan-1-amine;hydrochloride (PubChem CID 122640919) has the molecular formula C11H14ClN and a molecular weight of 195.69 g/mol. Its IUPAC name is 2-[(E)-2-phenylethenyl]cyclopropan-1-amine;hydrochloride.

Molecular Properties

Compound Name2-[(E)-2-phenylethenyl]cyclopropan-1-amine;hydrochloride
PubChem CID122640919
Molecular FormulaC11H14ClN
Molecular Weight195.69 g/mol
Exact Mass195.08
IUPAC Name2-[(E)-2-phenylethenyl]cyclopropan-1-amine;hydrochloride
SMILESCl.NC1CC1/C=C/c1ccccc1
InChIInChI=1S/C11H13N.ClH/c12-11-8-10(11)7-6-9-4-2-1-3-5-9;/h1-7,10-11H,8,12H2;1H/b7-6+;
InChIKeyBGDHHIOQHDVJQI-UHDJGPCESA-N
XLogP2.47
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.69
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-[(E)-2-phenylethenyl]cyclopropan-1-amine;hydrochloride 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

2-[(E)-2-phenylethenyl]cyclopropan-1-amine
CID 122640920
(1R,2R,4S,6R)-6-[(E)-2-phenylethenyl]bicyclo[2.2.1]heptan-2-amine
CID 102006219
4-N-[2-(2-phenylethenyl)cyclopropyl]cyclohexane-1,4-diamine;dihydrochloride
CID 135351315
(3S,3aR,6R,6aR)-3,6-bis(2-phenylethenyl)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
CID 170021549
2-[(E)-2-phenylethenyl]cyclopropan-1-one
CID 141437037
[(1R,2S,3S)-2-(hydroxymethyl)-3-[(E)-2-phenylethenyl]cyclopentyl]methanol
CID 166936172
1-[(1R,2R)-2-[(E)-2-phenylethenyl]cyclopropyl]-4-(trifluoromethyl)benzene
CID 166071874
3-[(E)-2-phenylethenyl]oxetane
CID 132578776
2-(2-phenylethenyl)-N-(piperidin-4-ylmethyl)cyclopropan-1-amine;dihydrochloride
CID 153307593
CID 70569152
CID 70569152
CID 70567885
CID 70567885
(1R,2R,3R)-3-benzoyl-2-[(E)-2-phenylethenyl]cyclopentane-1-carbaldehyde
CID 135063555

Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-phenylethenyl]cyclopropan-1-amine;hydrochloride?
The IUPAC name of 2-[(E)-2-phenylethenyl]cyclopropan-1-amine;hydrochloride (CID 122640919) is 2-[(E)-2-phenylethenyl]cyclopropan-1-amine;hydrochloride.
What is the SMILES notation for 2-[(E)-2-phenylethenyl]cyclopropan-1-amine;hydrochloride?
The canonical SMILES for 2-[(E)-2-phenylethenyl]cyclopropan-1-amine;hydrochloride is Cl.NC1CC1/C=C/c1ccccc1.
What is the InChIKey of 2-[(E)-2-phenylethenyl]cyclopropan-1-amine;hydrochloride?
The InChIKey is BGDHHIOQHDVJQI-UHDJGPCESA-N. The full InChI is InChI=1S/C11H13N.ClH/c12-11-8-10(11)7-6-9-4-2-1-3-5-9;/h1-7,10-11H,8,12H2;1H/b7-6+;.
What are the key properties of 2-[(E)-2-phenylethenyl]cyclopropan-1-amine;hydrochloride?
2-[(E)-2-phenylethenyl]cyclopropan-1-amine;hydrochloride has a molecular weight of 195.69 g/mol, XLogP of 2.47, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-phenylethenyl]cyclopropan-1-amine;hydrochloride is sourced from PubChem (CID 122640919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).