N-(2-methoxy-1-phenylethyl)-1-phenylbutan-1-amine

C19H25NO — CID 103902246

IUPACN-(2-methoxy-1-phenylethyl)-1-phenylbutan-1-amine
SMILESCCCC(NC(COC)c1ccccc1)c1ccccc1
InChIInChI=1S/C19H25NO/c1-3-10-18(16-11-6-4-7-12-16)20-19(15-21-2)17-13-8-5-9-14-17/h4-9,11-14,18-20H,3,10,15H2,1-2H3
InChIKeyFXKBLVQHZZNVQR-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.51
Rot. Bonds8

About N-(2-methoxy-1-phenylethyl)-1-phenylbutan-1-amine

N-(2-methoxy-1-phenylethyl)-1-phenylbutan-1-amine (PubChem CID 103902246) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is N-(2-methoxy-1-phenylethyl)-1-phenylbutan-1-amine.

Molecular Properties

Compound NameN-(2-methoxy-1-phenylethyl)-1-phenylbutan-1-amine
PubChem CID103902246
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC NameN-(2-methoxy-1-phenylethyl)-1-phenylbutan-1-amine
SMILESCCCC(NC(COC)c1ccccc1)c1ccccc1
InChIInChI=1S/C19H25NO/c1-3-10-18(16-11-6-4-7-12-16)20-19(15-21-2)17-13-8-5-9-14-17/h4-9,11-14,18-20H,3,10,15H2,1-2H3
InChIKeyFXKBLVQHZZNVQR-UHFFFAOYSA-N
XLogP4.51
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2-methoxy-1-phenylethyl)-1-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

(2S)-2-phenyl-2-(1-phenylbutylamino)ethanol
CID 103783978
1-phenyl-N-propan-2-ylbutan-1-amine
CID 43177244
N-(2,3-dimethoxypropyl)-1-phenylbutan-1-amine
CID 113368973
4-(1-phenylbutylamino)pentanal
CID 174525536
(E,1R)-N-[(1R)-2-methoxy-1-phenylethyl]-1-phenyl-4-trimethylsilylbut-3-en-1-amine
CID 23642490
3-N-(2-methoxy-1-phenylethyl)-1-N,1-N-dimethylbutane-1,3-diamine
CID 104864587
N-(1,1-difluoropropan-2-yl)-1-phenylbutan-1-amine
CID 102868679
(2S)-2-[[(1R)-2-methoxy-1-phenylethyl]amino]-3-methylbutan-1-ol
CID 101092421
4-methoxy-2,2-dimethyl-N-(1-phenylbutyl)butan-1-amine
CID 104628715
1-(1H-imidazol-2-yl)-N-(2-methoxy-1-phenylethyl)propan-1-amine
CID 103464718
N-[1-(3-methoxyphenyl)ethyl]-1-phenylbutan-1-amine
CID 43720331
N-[3-(2-methoxyethoxy)propyl]-1-phenylbutan-1-amine
CID 43206929

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-1-phenylethyl)-1-phenylbutan-1-amine?
The IUPAC name of N-(2-methoxy-1-phenylethyl)-1-phenylbutan-1-amine (CID 103902246) is N-(2-methoxy-1-phenylethyl)-1-phenylbutan-1-amine.
What is the SMILES notation for N-(2-methoxy-1-phenylethyl)-1-phenylbutan-1-amine?
The canonical SMILES for N-(2-methoxy-1-phenylethyl)-1-phenylbutan-1-amine is CCCC(NC(COC)c1ccccc1)c1ccccc1.
What is the InChIKey of N-(2-methoxy-1-phenylethyl)-1-phenylbutan-1-amine?
The InChIKey is FXKBLVQHZZNVQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-3-10-18(16-11-6-4-7-12-16)20-19(15-21-2)17-13-8-5-9-14-17/h4-9,11-14,18-20H,3,10,15H2,1-2H3.
What are the key properties of N-(2-methoxy-1-phenylethyl)-1-phenylbutan-1-amine?
N-(2-methoxy-1-phenylethyl)-1-phenylbutan-1-amine has a molecular weight of 283.42 g/mol, XLogP of 4.51, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-1-phenylethyl)-1-phenylbutan-1-amine is sourced from PubChem (CID 103902246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).