1-phenyl-N-(1-phenylethoxy)pentan-1-amine

C19H25NO — CID 15261429

IUPAC1-phenyl-N-(1-phenylethoxy)pentan-1-amine
SMILESCCCCC(NOC(C)c1ccccc1)c1ccccc1
InChIInChI=1S/C19H25NO/c1-3-4-15-19(18-13-9-6-10-14-18)20-21-16(2)17-11-7-5-8-12-17/h5-14,16,19-20H,3-4,15H2,1-2H3
InChIKeyFWNZVZDFPBMOAG-UHFFFAOYSA-N
MW283.42 g/mol
LogP5.20
Rot. Bonds8

About 1-phenyl-N-(1-phenylethoxy)pentan-1-amine

1-phenyl-N-(1-phenylethoxy)pentan-1-amine (PubChem CID 15261429) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 1-phenyl-N-(1-phenylethoxy)pentan-1-amine.

Molecular Properties

Compound Name1-phenyl-N-(1-phenylethoxy)pentan-1-amine
PubChem CID15261429
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name1-phenyl-N-(1-phenylethoxy)pentan-1-amine
SMILESCCCCC(NOC(C)c1ccccc1)c1ccccc1
InChIInChI=1S/C19H25NO/c1-3-4-15-19(18-13-9-6-10-14-18)20-21-16(2)17-11-7-5-8-12-17/h5-14,16,19-20H,3-4,15H2,1-2H3
InChIKeyFWNZVZDFPBMOAG-UHFFFAOYSA-N
XLogP5.20
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.42
LogP ≤ 55.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(1S,2R)-(+)-2-Amino-1,2-diphenylethanol
CID 719822
2-Amino-1,2-diphenylethanol
CID 22243
(1R,2S)-(-)-2-Amino-1,2-diphenylethanol
CID 719819
N-methyl-1,2-diphenylethanolamine
CID 99708
N-tert-Butyl-N-(2-methyl-1-phenylpropyl)-O-(1-phenylethyl)hydroxylamine
CID 6712809
(S)-2-(3,5-Dimethyl-benzyloxy)-1-phenyl-ethylamine
CID 44308930
BENZYL ALCOHOL, alpha-(alpha-AMINOBENZYL)-, HYDROCHLORIDE
CID 22242
(alphaR,betaR)-beta-Amino-alpha-phenylbenzeneethanol
CID 719820
(S,S)-(-)-2-Amino-1,2-diphenylethanol
CID 719821
(Benzyloxy)(pentyl)amine
CID 13736428
(1S,2R)-2-(Isopropylamino)-1,2-diphenylethanol
CID 688271
2-(Benzyloxy)-1-phenylethan-1-amine
CID 357710

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-N-(1-phenylethoxy)pentan-1-amine?
The IUPAC name of 1-phenyl-N-(1-phenylethoxy)pentan-1-amine (CID 15261429) is 1-phenyl-N-(1-phenylethoxy)pentan-1-amine.
What is the SMILES notation for 1-phenyl-N-(1-phenylethoxy)pentan-1-amine?
The canonical SMILES for 1-phenyl-N-(1-phenylethoxy)pentan-1-amine is CCCCC(NOC(C)c1ccccc1)c1ccccc1.
What is the InChIKey of 1-phenyl-N-(1-phenylethoxy)pentan-1-amine?
The InChIKey is FWNZVZDFPBMOAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-3-4-15-19(18-13-9-6-10-14-18)20-21-16(2)17-11-7-5-8-12-17/h5-14,16,19-20H,3-4,15H2,1-2H3.
What are the key properties of 1-phenyl-N-(1-phenylethoxy)pentan-1-amine?
1-phenyl-N-(1-phenylethoxy)pentan-1-amine has a molecular weight of 283.42 g/mol, XLogP of 5.20, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-(1-phenylethoxy)pentan-1-amine is sourced from PubChem (CID 15261429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).