[1-(methylaminomethyl)cyclopropyl]-(4-phenylphenyl)methanamine

C18H22N2 — CID 116943537

IUPAC[1-(methylaminomethyl)cyclopropyl]-(4-phenylphenyl)methanamine
SMILESCNCC1(C(N)c2ccc(-c3ccccc3)cc2)CC1
InChIInChI=1S/C18H22N2/c1-20-13-18(11-12-18)17(19)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h2-10,17,20H,11-13,19H2,1H3
InChIKeyOILRKZNYQMPHPQ-UHFFFAOYSA-N
MW266.39 g/mol
LogP3.35
Rot. Bonds5

About [1-(methylaminomethyl)cyclopropyl]-(4-phenylphenyl)methanamine

[1-(methylaminomethyl)cyclopropyl]-(4-phenylphenyl)methanamine (PubChem CID 116943537) has the molecular formula C18H22N2 and a molecular weight of 266.39 g/mol. Its IUPAC name is [1-(methylaminomethyl)cyclopropyl]-(4-phenylphenyl)methanamine.

Molecular Properties

Compound Name[1-(methylaminomethyl)cyclopropyl]-(4-phenylphenyl)methanamine
PubChem CID116943537
Molecular FormulaC18H22N2
Molecular Weight266.39 g/mol
Exact Mass266.18
IUPAC Name[1-(methylaminomethyl)cyclopropyl]-(4-phenylphenyl)methanamine
SMILESCNCC1(C(N)c2ccc(-c3ccccc3)cc2)CC1
InChIInChI=1S/C18H22N2/c1-20-13-18(11-12-18)17(19)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h2-10,17,20H,11-13,19H2,1H3
InChIKeyOILRKZNYQMPHPQ-UHFFFAOYSA-N
XLogP3.35
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [1-(methylaminomethyl)cyclopropyl]-(4-phenylphenyl)methanamine 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-tert-butylphenyl)-[1-(methylaminomethyl)cyclopropyl]methanamine
CID 116943497
(4-ethoxyphenyl)-[1-(methylaminomethyl)cyclopropyl]methanamine
CID 116943533
[1-(methylaminomethyl)cyclopropyl]-(2-methyl-3H-benzimidazol-5-yl)methanamine
CID 116943582
[1-(methylaminomethyl)cyclobutyl]-(1H-pyrrol-3-yl)methanamine
CID 116943976
1,3-benzodioxol-5-yl-[1-(methylaminomethyl)cyclobutyl]methanamine
CID 116943952
(5-chlorothiophen-2-yl)-[1-(methylaminomethyl)cyclopropyl]methanamine
CID 116943525
N-methyl-1-[1-(methylaminomethyl)cyclobutyl]-1-phenylmethanamine
CID 116958853
[1-(methylaminomethyl)cyclobutyl]-(2-methyl-5-propan-2-ylphenyl)methanamine
CID 116943982
[1-(methylaminomethyl)cyclopropyl]-(4-phenylphenyl)methanone
CID 116921365
[1-(aminomethyl)cyclobutyl]-phenylmethanamine
CID 116943782
2-(4-phenylphenyl)pentan-3-amine
CID 79308070
(1S)-1-(4-phenylphenyl)ethanamine;hydrochloride
CID 54594942

Frequently Asked Questions

What is the IUPAC name of [1-(methylaminomethyl)cyclopropyl]-(4-phenylphenyl)methanamine?
The IUPAC name of [1-(methylaminomethyl)cyclopropyl]-(4-phenylphenyl)methanamine (CID 116943537) is [1-(methylaminomethyl)cyclopropyl]-(4-phenylphenyl)methanamine.
What is the SMILES notation for [1-(methylaminomethyl)cyclopropyl]-(4-phenylphenyl)methanamine?
The canonical SMILES for [1-(methylaminomethyl)cyclopropyl]-(4-phenylphenyl)methanamine is CNCC1(C(N)c2ccc(-c3ccccc3)cc2)CC1.
What is the InChIKey of [1-(methylaminomethyl)cyclopropyl]-(4-phenylphenyl)methanamine?
The InChIKey is OILRKZNYQMPHPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2/c1-20-13-18(11-12-18)17(19)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h2-10,17,20H,11-13,19H2,1H3.
What are the key properties of [1-(methylaminomethyl)cyclopropyl]-(4-phenylphenyl)methanamine?
[1-(methylaminomethyl)cyclopropyl]-(4-phenylphenyl)methanamine has a molecular weight of 266.39 g/mol, XLogP of 3.35, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(methylaminomethyl)cyclopropyl]-(4-phenylphenyl)methanamine is sourced from PubChem (CID 116943537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).