N-[(2-cyclopropylphenyl)methyl]-1-(4-methylphenyl)ethanamine

C19H23N — CID 79889045

IUPACN-[(2-cyclopropylphenyl)methyl]-1-(4-methylphenyl)ethanamine
SMILESCc1ccc(C(C)NCc2ccccc2C2CC2)cc1
InChIInChI=1S/C19H23N/c1-14-7-9-16(10-8-14)15(2)20-13-18-5-3-4-6-19(18)17-11-12-17/h3-10,15,17,20H,11-13H2,1-2H3
InChIKeyFSNHKOCQDPRICD-UHFFFAOYSA-N
MW265.40 g/mol
LogP4.72
Rot. Bonds5

About N-[(2-cyclopropylphenyl)methyl]-1-(4-methylphenyl)ethanamine

N-[(2-cyclopropylphenyl)methyl]-1-(4-methylphenyl)ethanamine (PubChem CID 79889045) has the molecular formula C19H23N and a molecular weight of 265.40 g/mol. Its IUPAC name is N-[(2-cyclopropylphenyl)methyl]-1-(4-methylphenyl)ethanamine.

Molecular Properties

Compound NameN-[(2-cyclopropylphenyl)methyl]-1-(4-methylphenyl)ethanamine
PubChem CID79889045
Molecular FormulaC19H23N
Molecular Weight265.40 g/mol
Exact Mass265.18
IUPAC NameN-[(2-cyclopropylphenyl)methyl]-1-(4-methylphenyl)ethanamine
SMILESCc1ccc(C(C)NCc2ccccc2C2CC2)cc1
InChIInChI=1S/C19H23N/c1-14-7-9-16(10-8-14)15(2)20-13-18-5-3-4-6-19(18)17-11-12-17/h3-10,15,17,20H,11-13H2,1-2H3
InChIKeyFSNHKOCQDPRICD-UHFFFAOYSA-N
XLogP4.72
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R)-1-(4-chlorophenyl)-N-[(2-cyclopropylphenyl)methyl]ethanamine
CID 81356331
N-[(2-cyclopropylphenyl)methyl]-1-thiophen-3-ylethanamine
CID 79984304
N-[(2-cyclopropylphenyl)methyl]but-3-yn-2-amine
CID 114415138
(1R)-N-[(2-cyclopropylphenyl)methyl]-1-thiophen-2-ylethanamine
CID 81398472
(1S)-N-[(3-cyclopropylphenyl)methyl]-1-(4-methylphenyl)ethanamine
CID 81356483
(1R)-N-[(2-cyclopropylphenyl)methyl]-1-(2-fluorophenyl)ethanamine
CID 81379917
N-[(2-cyclopropylphenyl)methyl]-1-(2,6-difluorophenyl)ethanamine
CID 79884254
N-[(2-cyclopropylphenyl)methyl]-1-methylsulfanylpropan-2-amine
CID 115682727
(1R)-1-(4-methylphenyl)-N-[[2-(trifluoromethyl)phenyl]methyl]ethanamine
CID 81348504
1-(4-methylphenyl)-N-[[2-(trifluoromethyl)phenyl]methyl]ethanamine
CID 60944396
2-[[[(1S)-1-(4-methylphenyl)ethyl]amino]methyl]benzoic acid
CID 103258886
2-bromo-6-[[[(1R)-1-(4-methylphenyl)ethyl]amino]methyl]phenol
CID 81350041

Frequently Asked Questions

What is the IUPAC name of N-[(2-cyclopropylphenyl)methyl]-1-(4-methylphenyl)ethanamine?
The IUPAC name of N-[(2-cyclopropylphenyl)methyl]-1-(4-methylphenyl)ethanamine (CID 79889045) is N-[(2-cyclopropylphenyl)methyl]-1-(4-methylphenyl)ethanamine.
What is the SMILES notation for N-[(2-cyclopropylphenyl)methyl]-1-(4-methylphenyl)ethanamine?
The canonical SMILES for N-[(2-cyclopropylphenyl)methyl]-1-(4-methylphenyl)ethanamine is Cc1ccc(C(C)NCc2ccccc2C2CC2)cc1.
What is the InChIKey of N-[(2-cyclopropylphenyl)methyl]-1-(4-methylphenyl)ethanamine?
The InChIKey is FSNHKOCQDPRICD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N/c1-14-7-9-16(10-8-14)15(2)20-13-18-5-3-4-6-19(18)17-11-12-17/h3-10,15,17,20H,11-13H2,1-2H3.
What are the key properties of N-[(2-cyclopropylphenyl)methyl]-1-(4-methylphenyl)ethanamine?
N-[(2-cyclopropylphenyl)methyl]-1-(4-methylphenyl)ethanamine has a molecular weight of 265.40 g/mol, XLogP of 4.72, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-cyclopropylphenyl)methyl]-1-(4-methylphenyl)ethanamine is sourced from PubChem (CID 79889045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).