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

C19H25N — CID 63411938

IUPACN-ethyl-1-(4-methylphenyl)-4-phenylbutan-1-amine
SMILESCCNC(CCCc1ccccc1)c1ccc(C)cc1
InChIInChI=1S/C19H25N/c1-3-20-19(18-14-12-16(2)13-15-18)11-7-10-17-8-5-4-6-9-17/h4-6,8-9,12-15,19-20H,3,7,10-11H2,1-2H3
InChIKeyPKKHRVMVHJZCJI-UHFFFAOYSA-N
MW267.42 g/mol
LogP4.67
Rot. Bonds7

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

N-ethyl-1-(4-methylphenyl)-4-phenylbutan-1-amine (PubChem CID 63411938) has the molecular formula C19H25N and a molecular weight of 267.42 g/mol. Its IUPAC name is N-ethyl-1-(4-methylphenyl)-4-phenylbutan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-(4-methylphenyl)-4-phenylbutan-1-amine
PubChem CID63411938
Molecular FormulaC19H25N
Molecular Weight267.42 g/mol
Exact Mass267.20
IUPAC NameN-ethyl-1-(4-methylphenyl)-4-phenylbutan-1-amine
SMILESCCNC(CCCc1ccccc1)c1ccc(C)cc1
InChIInChI=1S/C19H25N/c1-3-20-19(18-14-12-16(2)13-15-18)11-7-10-17-8-5-4-6-9-17/h4-6,8-9,12-15,19-20H,3,7,10-11H2,1-2H3
InChIKeyPKKHRVMVHJZCJI-UHFFFAOYSA-N
XLogP4.67
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 ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-ethyl-1-(4-methylphenyl)-4-phenylbutan-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-ethyl-1-(3-methylphenyl)-4-phenylbutan-1-amine
CID 63413344
1-(2-chloro-4-methylphenyl)-N-ethyl-4-phenylbutan-1-amine
CID 106857406
N-ethyl-3-(2-methylphenyl)-1-(4-methylphenyl)propan-1-amine
CID 105092556
N-ethyl-4-phenyl-1-(2,4,5-trimethylfuran-3-yl)butan-1-amine
CID 115849308
N-ethyl-1-(1-methylpyrazol-4-yl)-4-phenylbutan-1-amine
CID 65195286
4-(2,6-difluorophenyl)-N-ethyl-1-phenylbutan-1-amine
CID 114934436
1-(2,6-dimethyl-3-pyridinyl)-N-ethyl-4-phenylbutan-1-amine
CID 105139820
1-(4-methylphenyl)-4-phenylbutan-1-amine
CID 62608343
2-(4-methylphenyl)-5-phenylpentanenitrile
CID 82137049
3-(ethylamino)-3-(4-methylphenyl)propan-1-ol
CID 64813855
N-ethyl-2-phenyl-1-(4-propylphenyl)ethanamine
CID 43491649
1-(4-bromo-3-methylphenyl)-N-ethyl-3-phenylpropan-1-amine
CID 115793778

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(4-methylphenyl)-4-phenylbutan-1-amine?
The IUPAC name of N-ethyl-1-(4-methylphenyl)-4-phenylbutan-1-amine (CID 63411938) is N-ethyl-1-(4-methylphenyl)-4-phenylbutan-1-amine.
What is the SMILES notation for N-ethyl-1-(4-methylphenyl)-4-phenylbutan-1-amine?
The canonical SMILES for N-ethyl-1-(4-methylphenyl)-4-phenylbutan-1-amine is CCNC(CCCc1ccccc1)c1ccc(C)cc1.
What is the InChIKey of N-ethyl-1-(4-methylphenyl)-4-phenylbutan-1-amine?
The InChIKey is PKKHRVMVHJZCJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N/c1-3-20-19(18-14-12-16(2)13-15-18)11-7-10-17-8-5-4-6-9-17/h4-6,8-9,12-15,19-20H,3,7,10-11H2,1-2H3.
What are the key properties of N-ethyl-1-(4-methylphenyl)-4-phenylbutan-1-amine?
N-ethyl-1-(4-methylphenyl)-4-phenylbutan-1-amine has a molecular weight of 267.42 g/mol, XLogP of 4.67, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(4-methylphenyl)-4-phenylbutan-1-amine is sourced from PubChem (CID 63411938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).