2-methoxy-N,3-dimethyl-1-(4-phenylphenyl)butan-1-amine

C19H25NO — CID 116720033

IUPAC2-methoxy-N,3-dimethyl-1-(4-phenylphenyl)butan-1-amine
SMILESCNC(c1ccc(-c2ccccc2)cc1)C(OC)C(C)C
InChIInChI=1S/C19H25NO/c1-14(2)19(21-4)18(20-3)17-12-10-16(11-13-17)15-8-6-5-7-9-15/h5-14,18-20H,1-4H3
InChIKeyQFHKVJGEDRYUCO-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.29
Rot. Bonds6

About 2-methoxy-N,3-dimethyl-1-(4-phenylphenyl)butan-1-amine

2-methoxy-N,3-dimethyl-1-(4-phenylphenyl)butan-1-amine (PubChem CID 116720033) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 2-methoxy-N,3-dimethyl-1-(4-phenylphenyl)butan-1-amine.

Molecular Properties

Compound Name2-methoxy-N,3-dimethyl-1-(4-phenylphenyl)butan-1-amine
PubChem CID116720033
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name2-methoxy-N,3-dimethyl-1-(4-phenylphenyl)butan-1-amine
SMILESCNC(c1ccc(-c2ccccc2)cc1)C(OC)C(C)C
InChIInChI=1S/C19H25NO/c1-14(2)19(21-4)18(20-3)17-12-10-16(11-13-17)15-8-6-5-7-9-15/h5-14,18-20H,1-4H3
InChIKeyQFHKVJGEDRYUCO-UHFFFAOYSA-N
XLogP4.29
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine
CID 105271982
1-(4-cyclopropyloxyphenyl)-2-methoxy-N,3-dimethylbutan-1-amine
CID 114519800
2-methoxy-1-(3-methoxyphenyl)-N,3-dimethylbutan-1-amine
CID 116719987
2-cyclopropyl-N-methyl-1-(4-phenylphenyl)propan-1-amine
CID 83154674
2-methoxy-N,3-dimethyl-1-quinolin-6-ylbutan-1-amine
CID 116720092
1-(3,4-diethoxyphenyl)-2-methoxy-N,3-dimethylbutan-1-amine
CID 116720003
1-(1-benzofuran-2-yl)-2-methoxy-N,3-dimethylbutan-1-amine
CID 114731162
methyl 3-methyl-2-(4-phenylphenyl)butanoate
CID 65454371
[2-methoxy-1-(4-phenylphenyl)butyl]hydrazine
CID 105270591
1-phenyl-4-[4-[1-(4-phenylphenyl)ethyl]phenyl]benzene
CID 174323056
2-methoxy-2-(4-phenylphenyl)acetonitrile
CID 66070699
2-ethoxy-N,3-dimethyl-1-(4-propan-2-ylphenyl)butan-1-amine
CID 116721056

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N,3-dimethyl-1-(4-phenylphenyl)butan-1-amine?
The IUPAC name of 2-methoxy-N,3-dimethyl-1-(4-phenylphenyl)butan-1-amine (CID 116720033) is 2-methoxy-N,3-dimethyl-1-(4-phenylphenyl)butan-1-amine.
What is the SMILES notation for 2-methoxy-N,3-dimethyl-1-(4-phenylphenyl)butan-1-amine?
The canonical SMILES for 2-methoxy-N,3-dimethyl-1-(4-phenylphenyl)butan-1-amine is CNC(c1ccc(-c2ccccc2)cc1)C(OC)C(C)C.
What is the InChIKey of 2-methoxy-N,3-dimethyl-1-(4-phenylphenyl)butan-1-amine?
The InChIKey is QFHKVJGEDRYUCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-14(2)19(21-4)18(20-3)17-12-10-16(11-13-17)15-8-6-5-7-9-15/h5-14,18-20H,1-4H3.
What are the key properties of 2-methoxy-N,3-dimethyl-1-(4-phenylphenyl)butan-1-amine?
2-methoxy-N,3-dimethyl-1-(4-phenylphenyl)butan-1-amine has a molecular weight of 283.42 g/mol, XLogP of 4.29, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N,3-dimethyl-1-(4-phenylphenyl)butan-1-amine is sourced from PubChem (CID 116720033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).