N-[(R)-(4-methylphenyl)-phenylmethyl]propan-1-amine

C17H21N — CID 93032197

IUPACN-[(R)-(4-methylphenyl)-phenylmethyl]propan-1-amine
SMILESCCCN[C@H](c1ccccc1)c1ccc(C)cc1
InChIInChI=1S/C17H21N/c1-3-13-18-17(15-7-5-4-6-8-15)16-11-9-14(2)10-12-16/h4-12,17-18H,3,13H2,1-2H3/t17-/m1/s1
InChIKeyATEWGWDYSQOONI-QGZVFWFLSA-N
MW239.36 g/mol
LogP4.08
Rot. Bonds5

About N-[(R)-(4-methylphenyl)-phenylmethyl]propan-1-amine

N-[(R)-(4-methylphenyl)-phenylmethyl]propan-1-amine (PubChem CID 93032197) has the molecular formula C17H21N and a molecular weight of 239.36 g/mol. Its IUPAC name is N-[(R)-(4-methylphenyl)-phenylmethyl]propan-1-amine.

Molecular Properties

Compound NameN-[(R)-(4-methylphenyl)-phenylmethyl]propan-1-amine
PubChem CID93032197
Molecular FormulaC17H21N
Molecular Weight239.36 g/mol
Exact Mass239.17
IUPAC NameN-[(R)-(4-methylphenyl)-phenylmethyl]propan-1-amine
SMILESCCCN[C@H](c1ccccc1)c1ccc(C)cc1
InChIInChI=1S/C17H21N/c1-3-13-18-17(15-7-5-4-6-8-15)16-11-9-14(2)10-12-16/h4-12,17-18H,3,13H2,1-2H3/t17-/m1/s1
InChIKeyATEWGWDYSQOONI-QGZVFWFLSA-N
XLogP4.08
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[(R)-(4-methylphenyl)-phenylmethyl]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-[(4-methylphenyl)-phenylmethyl]octan-1-amine
CID 3847928
N-[(4-methylphenyl)-phenylmethyl]ethanamine
CID 43389847
N-[(4-ethylphenyl)-phenylmethyl]propan-1-amine
CID 43494878
N-[(4-methylphenyl)-(3-propylphenyl)methyl]propan-1-amine
CID 116543927
N-[(2-iodophenyl)-(4-methylphenyl)methyl]propan-1-amine
CID 43495083
N-[(3,4-difluorophenyl)-phenylmethyl]propan-1-amine
CID 43494885
N-[2-(4-methylphenyl)-1-phenylethyl]propan-1-amine
CID 43494855
N-[1-(4-methylphenyl)-2-phenylethyl]propan-1-amine
CID 43495145
N-[(5-methyl-1-benzofuran-2-yl)-phenylmethyl]propan-1-amine
CID 114727860
1-[(4-methylphenyl)-phenylmethyl]-3-propylurea
CID 133230842
2-[2-[[(4-methylphenyl)-phenylmethyl]amino]ethoxy]ethanol
CID 110878023
N-[(3,4-dimethoxyphenyl)-phenylmethyl]propan-1-amine
CID 43494597

Frequently Asked Questions

What is the IUPAC name of N-[(R)-(4-methylphenyl)-phenylmethyl]propan-1-amine?
The IUPAC name of N-[(R)-(4-methylphenyl)-phenylmethyl]propan-1-amine (CID 93032197) is N-[(R)-(4-methylphenyl)-phenylmethyl]propan-1-amine.
What is the SMILES notation for N-[(R)-(4-methylphenyl)-phenylmethyl]propan-1-amine?
The canonical SMILES for N-[(R)-(4-methylphenyl)-phenylmethyl]propan-1-amine is CCCN[C@H](c1ccccc1)c1ccc(C)cc1.
What is the InChIKey of N-[(R)-(4-methylphenyl)-phenylmethyl]propan-1-amine?
The InChIKey is ATEWGWDYSQOONI-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H21N/c1-3-13-18-17(15-7-5-4-6-8-15)16-11-9-14(2)10-12-16/h4-12,17-18H,3,13H2,1-2H3/t17-/m1/s1.
What are the key properties of N-[(R)-(4-methylphenyl)-phenylmethyl]propan-1-amine?
N-[(R)-(4-methylphenyl)-phenylmethyl]propan-1-amine has a molecular weight of 239.36 g/mol, XLogP of 4.08, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(R)-(4-methylphenyl)-phenylmethyl]propan-1-amine is sourced from PubChem (CID 93032197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).