N-ethyl-2-phenyl-3-phenylmethoxypropan-1-amine

C18H23NO — CID 102940555

IUPACN-ethyl-2-phenyl-3-phenylmethoxypropan-1-amine
SMILESCCNCC(COCc1ccccc1)c1ccccc1
InChIInChI=1S/C18H23NO/c1-2-19-13-18(17-11-7-4-8-12-17)15-20-14-16-9-5-3-6-10-16/h3-12,18-19H,2,13-15H2,1H3
InChIKeyQLWKMBVYPBUVMP-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.60
Rot. Bonds8

About N-ethyl-2-phenyl-3-phenylmethoxypropan-1-amine

N-ethyl-2-phenyl-3-phenylmethoxypropan-1-amine (PubChem CID 102940555) has the molecular formula C18H23NO and a molecular weight of 269.39 g/mol. Its IUPAC name is N-ethyl-2-phenyl-3-phenylmethoxypropan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-phenyl-3-phenylmethoxypropan-1-amine
PubChem CID102940555
Molecular FormulaC18H23NO
Molecular Weight269.39 g/mol
Exact Mass269.18
IUPAC NameN-ethyl-2-phenyl-3-phenylmethoxypropan-1-amine
SMILESCCNCC(COCc1ccccc1)c1ccccc1
InChIInChI=1S/C18H23NO/c1-2-19-13-18(17-11-7-4-8-12-17)15-20-14-16-9-5-3-6-10-16/h3-12,18-19H,2,13-15H2,1H3
InChIKeyQLWKMBVYPBUVMP-UHFFFAOYSA-N
XLogP3.60
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chlorophenyl)-N-ethyl-3-phenylmethoxypropan-1-amine
CID 102940598
N-methyl-2-(4-methylphenyl)-3-phenylmethoxypropan-1-amine
CID 102940575
N-ethyl-2,4-diphenylbutan-1-amine
CID 81024071
5-ethoxy-N-ethyl-2-phenylpentan-1-amine
CID 65430782
N-methyl-2-(2-methylphenyl)-3-phenylmethoxypropan-1-amine
CID 102940569
N-methyl-2-(phenylmethoxymethyl)pentan-1-amine
CID 102940428
2-benzyl-N-methyl-3-phenylmethoxypropan-1-amine
CID 102940419
3-methoxy-2-phenyl-N-propylpropan-1-amine
CID 103984694
4-(3-bromophenyl)-N-ethyl-2-phenylbutan-1-amine
CID 81024527
N-ethyl-2-phenyl-3-pyrimidin-5-ylpropan-1-amine
CID 81024667
N-ethyl-6-methoxy-2-phenylhexan-1-amine
CID 81024742
N-methyl-1,3-bis(phenylmethoxy)propan-2-amine
CID 20583824

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-phenyl-3-phenylmethoxypropan-1-amine?
The IUPAC name of N-ethyl-2-phenyl-3-phenylmethoxypropan-1-amine (CID 102940555) is N-ethyl-2-phenyl-3-phenylmethoxypropan-1-amine.
What is the SMILES notation for N-ethyl-2-phenyl-3-phenylmethoxypropan-1-amine?
The canonical SMILES for N-ethyl-2-phenyl-3-phenylmethoxypropan-1-amine is CCNCC(COCc1ccccc1)c1ccccc1.
What is the InChIKey of N-ethyl-2-phenyl-3-phenylmethoxypropan-1-amine?
The InChIKey is QLWKMBVYPBUVMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO/c1-2-19-13-18(17-11-7-4-8-12-17)15-20-14-16-9-5-3-6-10-16/h3-12,18-19H,2,13-15H2,1H3.
What are the key properties of N-ethyl-2-phenyl-3-phenylmethoxypropan-1-amine?
N-ethyl-2-phenyl-3-phenylmethoxypropan-1-amine has a molecular weight of 269.39 g/mol, XLogP of 3.60, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-phenyl-3-phenylmethoxypropan-1-amine is sourced from PubChem (CID 102940555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).