4-(4-methoxyphenyl)-N-(1-phenylethyl)butan-2-amine

C19H25NO — CID 19981570

IUPAC4-(4-methoxyphenyl)-N-(1-phenylethyl)butan-2-amine
SMILESCOc1ccc(CCC(C)NC(C)c2ccccc2)cc1
InChIInChI=1S/C19H25NO/c1-15(20-16(2)18-7-5-4-6-8-18)9-10-17-11-13-19(21-3)14-12-17/h4-8,11-16,20H,9-10H2,1-3H3
InChIKeyOOAJWANQSQPKFK-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.37
Rot. Bonds7

About 4-(4-methoxyphenyl)-N-(1-phenylethyl)butan-2-amine

4-(4-methoxyphenyl)-N-(1-phenylethyl)butan-2-amine (PubChem CID 19981570) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 4-(4-methoxyphenyl)-N-(1-phenylethyl)butan-2-amine.

Molecular Properties

Compound Name4-(4-methoxyphenyl)-N-(1-phenylethyl)butan-2-amine
PubChem CID19981570
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name4-(4-methoxyphenyl)-N-(1-phenylethyl)butan-2-amine
SMILESCOc1ccc(CCC(C)NC(C)c2ccccc2)cc1
InChIInChI=1S/C19H25NO/c1-15(20-16(2)18-7-5-4-6-8-18)9-10-17-11-13-19(21-3)14-12-17/h4-8,11-16,20H,9-10H2,1-3H3
InChIKeyOOAJWANQSQPKFK-UHFFFAOYSA-N
XLogP4.37
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(4-methoxyphenyl)-N-[(1R)-1-phenylethyl]butan-2-amine
CID 81350768
N-[(1S)-1-(4-methoxyphenyl)ethyl]-4-phenylbutan-2-amine
CID 81368068
N-[(1R)-1-(4-methoxyphenyl)ethyl]-4-phenylbutan-2-amine
CID 81367480
N-benzhydryl-4-(4-methoxyphenyl)butan-2-amine
CID 2846404
(2S)-4-phenyl-N-[(1R)-1-phenylethyl]butan-2-amine
CID 12814796
4-(4-methoxyphenyl)-N-[(1R)-1-pyridin-4-ylethyl]butan-2-amine
CID 81394593
N-[(1S)-1-(3-methoxyphenyl)ethyl]-4-phenylbutan-2-amine
CID 81354744
(2R)-2-[[(2S)-4-(4-methoxyphenyl)butan-2-yl]amino]-2-phenylacetamide
CID 95588807
methyl 4-[3-[[(1S)-1-phenylethyl]amino]butyl]benzoate
CID 22823575
N-[1-(furan-2-yl)ethyl]-4-(4-methoxyphenyl)butan-2-amine
CID 43776737
(2R)-N-[2-(4-methoxyphenyl)ethyl]-4-phenylbutan-2-amine
CID 7445911
N-(4-methoxybutan-2-yl)-4-(4-methoxyphenyl)butan-2-amine
CID 64600673

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxyphenyl)-N-(1-phenylethyl)butan-2-amine?
The IUPAC name of 4-(4-methoxyphenyl)-N-(1-phenylethyl)butan-2-amine (CID 19981570) is 4-(4-methoxyphenyl)-N-(1-phenylethyl)butan-2-amine.
What is the SMILES notation for 4-(4-methoxyphenyl)-N-(1-phenylethyl)butan-2-amine?
The canonical SMILES for 4-(4-methoxyphenyl)-N-(1-phenylethyl)butan-2-amine is COc1ccc(CCC(C)NC(C)c2ccccc2)cc1.
What is the InChIKey of 4-(4-methoxyphenyl)-N-(1-phenylethyl)butan-2-amine?
The InChIKey is OOAJWANQSQPKFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-15(20-16(2)18-7-5-4-6-8-18)9-10-17-11-13-19(21-3)14-12-17/h4-8,11-16,20H,9-10H2,1-3H3.
What are the key properties of 4-(4-methoxyphenyl)-N-(1-phenylethyl)butan-2-amine?
4-(4-methoxyphenyl)-N-(1-phenylethyl)butan-2-amine has a molecular weight of 283.42 g/mol, XLogP of 4.37, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxyphenyl)-N-(1-phenylethyl)butan-2-amine is sourced from PubChem (CID 19981570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).