N-[(2-chlorophenyl)-(2-phenylcyclopropyl)methyl]propan-1-amine

C19H22ClN — CID 116517442

IUPACN-[(2-chlorophenyl)-(2-phenylcyclopropyl)methyl]propan-1-amine
SMILESCCCNC(c1ccccc1Cl)C1CC1c1ccccc1
InChIInChI=1S/C19H22ClN/c1-2-12-21-19(15-10-6-7-11-18(15)20)17-13-16(17)14-8-4-3-5-9-14/h3-11,16-17,19,21H,2,12-13H2,1H3
InChIKeyHPVTUQHASJOAME-UHFFFAOYSA-N
MW299.85 g/mol
LogP5.18
Rot. Bonds6

About N-[(2-chlorophenyl)-(2-phenylcyclopropyl)methyl]propan-1-amine

N-[(2-chlorophenyl)-(2-phenylcyclopropyl)methyl]propan-1-amine (PubChem CID 116517442) has the molecular formula C19H22ClN and a molecular weight of 299.85 g/mol. Its IUPAC name is N-[(2-chlorophenyl)-(2-phenylcyclopropyl)methyl]propan-1-amine.

Molecular Properties

Compound NameN-[(2-chlorophenyl)-(2-phenylcyclopropyl)methyl]propan-1-amine
PubChem CID116517442
Molecular FormulaC19H22ClN
Molecular Weight299.85 g/mol
Exact Mass299.14
IUPAC NameN-[(2-chlorophenyl)-(2-phenylcyclopropyl)methyl]propan-1-amine
SMILESCCCNC(c1ccccc1Cl)C1CC1c1ccccc1
InChIInChI=1S/C19H22ClN/c1-2-12-21-19(15-10-6-7-11-18(15)20)17-13-16(17)14-8-4-3-5-9-14/h3-11,16-17,19,21H,2,12-13H2,1H3
InChIKeyHPVTUQHASJOAME-UHFFFAOYSA-N
XLogP5.18
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500299.85
LogP ≤ 55.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[(2-chlorophenyl)-(2-phenylcyclopropyl)methyl]propan-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

N-[(5-chlorofuran-2-yl)-(2-phenylcyclopropyl)methyl]propan-1-amine
CID 106693341
[(2-chlorophenyl)-(2-phenylcyclopropyl)methyl]hydrazine
CID 105211221
N-[(2-chlorophenyl)-cyclopropylmethyl]propan-1-amine
CID 61030394
N-[(1,5-dimethylpyrazol-4-yl)-(2-phenylcyclopropyl)methyl]propan-1-amine
CID 105188964
N-[(5-methylpyrimidin-2-yl)-(2-phenylcyclopropyl)methyl]propan-1-amine
CID 116517868
N-[(3-iodophenyl)-(2-phenylcyclopropyl)methyl]propan-1-amine
CID 105052524
N-[(5-methylpyrazin-2-yl)-(2-phenylcyclopropyl)methyl]propan-1-amine
CID 105189004
N-[2,2-diethoxy-1-(2-phenylcyclopropyl)ethyl]propan-1-amine
CID 116517734
N-[(2-chloro-6-fluorophenyl)-(2-phenylcyclopropyl)methyl]ethanamine
CID 105052491
N-[(2-chlorophenyl)-(4-propylcyclohexyl)methyl]propan-1-amine
CID 65425524
N-[(5-fluoro-3-pyridinyl)-(2-phenylcyclopropyl)methyl]propan-1-amine
CID 115804971
N-[3-bicyclo[3.1.0]hexanyl-(2-phenylcyclopropyl)methyl]propan-1-amine
CID 105052478

Frequently Asked Questions

What is the IUPAC name of N-[(2-chlorophenyl)-(2-phenylcyclopropyl)methyl]propan-1-amine?
The IUPAC name of N-[(2-chlorophenyl)-(2-phenylcyclopropyl)methyl]propan-1-amine (CID 116517442) is N-[(2-chlorophenyl)-(2-phenylcyclopropyl)methyl]propan-1-amine.
What is the SMILES notation for N-[(2-chlorophenyl)-(2-phenylcyclopropyl)methyl]propan-1-amine?
The canonical SMILES for N-[(2-chlorophenyl)-(2-phenylcyclopropyl)methyl]propan-1-amine is CCCNC(c1ccccc1Cl)C1CC1c1ccccc1.
What is the InChIKey of N-[(2-chlorophenyl)-(2-phenylcyclopropyl)methyl]propan-1-amine?
The InChIKey is HPVTUQHASJOAME-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClN/c1-2-12-21-19(15-10-6-7-11-18(15)20)17-13-16(17)14-8-4-3-5-9-14/h3-11,16-17,19,21H,2,12-13H2,1H3.
What are the key properties of N-[(2-chlorophenyl)-(2-phenylcyclopropyl)methyl]propan-1-amine?
N-[(2-chlorophenyl)-(2-phenylcyclopropyl)methyl]propan-1-amine has a molecular weight of 299.85 g/mol, XLogP of 5.18, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chlorophenyl)-(2-phenylcyclopropyl)methyl]propan-1-amine is sourced from PubChem (CID 116517442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).