N-ethyl-1-(2-methylphenyl)-4-phenylbutan-2-amine

C19H25N — CID 61065597

IUPACN-ethyl-1-(2-methylphenyl)-4-phenylbutan-2-amine
SMILESCCNC(CCc1ccccc1)Cc1ccccc1C
InChIInChI=1S/C19H25N/c1-3-20-19(14-13-17-10-5-4-6-11-17)15-18-12-8-7-9-16(18)2/h4-12,19-20H,3,13-15H2,1-2H3
InChIKeyGMGZBYKPZWTUHK-UHFFFAOYSA-N
MW267.42 g/mol
LogP4.15
Rot. Bonds7

About N-ethyl-1-(2-methylphenyl)-4-phenylbutan-2-amine

N-ethyl-1-(2-methylphenyl)-4-phenylbutan-2-amine (PubChem CID 61065597) has the molecular formula C19H25N and a molecular weight of 267.42 g/mol. Its IUPAC name is N-ethyl-1-(2-methylphenyl)-4-phenylbutan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-(2-methylphenyl)-4-phenylbutan-2-amine
PubChem CID61065597
Molecular FormulaC19H25N
Molecular Weight267.42 g/mol
Exact Mass267.20
IUPAC NameN-ethyl-1-(2-methylphenyl)-4-phenylbutan-2-amine
SMILESCCNC(CCc1ccccc1)Cc1ccccc1C
InChIInChI=1S/C19H25N/c1-3-20-19(14-13-17-10-5-4-6-11-17)15-18-12-8-7-9-16(18)2/h4-12,19-20H,3,13-15H2,1-2H3
InChIKeyGMGZBYKPZWTUHK-UHFFFAOYSA-N
XLogP4.15
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-chlorophenyl)-N-ethyl-4-phenylbutan-2-amine
CID 63417051
N-ethyl-1-(3-fluorophenyl)-4-(2-methylphenyl)butan-2-amine
CID 62367606
4-ethoxy-N-ethyl-1-(2-methylphenyl)butan-2-amine
CID 55090548
N-ethyl-1-(2-methylphenyl)decan-2-amine
CID 63417244
1-(2-bromo-5-fluorophenyl)-N-ethyl-4-phenylbutan-2-amine
CID 63416964
1-(2-chloro-5-fluorophenyl)-N-ethyl-4-phenylbutan-2-amine
CID 102618741
1-(2,4-dichlorophenyl)-N-ethyl-4-phenylbutan-2-amine
CID 60819236
N,5-diethyl-1-(2-methylphenyl)heptan-3-amine
CID 105176885
N-ethyl-1-(2-methylphenyl)heptan-3-amine
CID 105125674
N-ethyl-4-(2-methylphenyl)-1-(1-methylpyrazol-4-yl)butan-2-amine
CID 105114186
1-(2,5-dimethylphenyl)-N-ethyl-4-pyridin-4-ylbutan-2-amine
CID 105101158
N-ethyl-6,6,6-trifluoro-1-phenylhexan-3-amine
CID 64566807

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(2-methylphenyl)-4-phenylbutan-2-amine?
The IUPAC name of N-ethyl-1-(2-methylphenyl)-4-phenylbutan-2-amine (CID 61065597) is N-ethyl-1-(2-methylphenyl)-4-phenylbutan-2-amine.
What is the SMILES notation for N-ethyl-1-(2-methylphenyl)-4-phenylbutan-2-amine?
The canonical SMILES for N-ethyl-1-(2-methylphenyl)-4-phenylbutan-2-amine is CCNC(CCc1ccccc1)Cc1ccccc1C.
What is the InChIKey of N-ethyl-1-(2-methylphenyl)-4-phenylbutan-2-amine?
The InChIKey is GMGZBYKPZWTUHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N/c1-3-20-19(14-13-17-10-5-4-6-11-17)15-18-12-8-7-9-16(18)2/h4-12,19-20H,3,13-15H2,1-2H3.
What are the key properties of N-ethyl-1-(2-methylphenyl)-4-phenylbutan-2-amine?
N-ethyl-1-(2-methylphenyl)-4-phenylbutan-2-amine has a molecular weight of 267.42 g/mol, XLogP of 4.15, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(2-methylphenyl)-4-phenylbutan-2-amine is sourced from PubChem (CID 61065597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).