2,2-dimethyl-1-phenyl-N-(1-phenylethoxy)propan-1-amine

C19H25NO — CID 15261430

IUPAC2,2-dimethyl-1-phenyl-N-(1-phenylethoxy)propan-1-amine
SMILESCC(ONC(c1ccccc1)C(C)(C)C)c1ccccc1
InChIInChI=1S/C19H25NO/c1-15(16-11-7-5-8-12-16)21-20-18(19(2,3)4)17-13-9-6-10-14-17/h5-15,18,20H,1-4H3
InChIKeyOUBASLZMIDNTBI-UHFFFAOYSA-N
MW283.42 g/mol
LogP5.06
Rot. Bonds5

About 2,2-dimethyl-1-phenyl-N-(1-phenylethoxy)propan-1-amine

2,2-dimethyl-1-phenyl-N-(1-phenylethoxy)propan-1-amine (PubChem CID 15261430) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 2,2-dimethyl-1-phenyl-N-(1-phenylethoxy)propan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-1-phenyl-N-(1-phenylethoxy)propan-1-amine
PubChem CID15261430
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name2,2-dimethyl-1-phenyl-N-(1-phenylethoxy)propan-1-amine
SMILESCC(ONC(c1ccccc1)C(C)(C)C)c1ccccc1
InChIInChI=1S/C19H25NO/c1-15(16-11-7-5-8-12-16)21-20-18(19(2,3)4)17-13-9-6-10-14-17/h5-15,18,20H,1-4H3
InChIKeyOUBASLZMIDNTBI-UHFFFAOYSA-N
XLogP5.06
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.42
LogP ≤ 55.06
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-tert-Butyl-N-(2-methyl-1-phenylpropyl)-O-(1-phenylethyl)hydroxylamine
CID 6712809
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
3-Amino-1,3-diphenylpropan-1-ol
CID 283198
Benzeneethanamine, N-(phenylmethoxy)-
CID 14545021
2-methyl-1-phenyl-N-(1-phenylethoxy)propan-1-amine
CID 15261432
2-Amino-1,2-diphenylethan-1-ol--hydrogen chloride (1/1)
CID 234544
(4R)-N-[(1S)-1-phenylbutoxy]non-8-en-4-amine
CID 10708581

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-1-phenyl-N-(1-phenylethoxy)propan-1-amine?
The IUPAC name of 2,2-dimethyl-1-phenyl-N-(1-phenylethoxy)propan-1-amine (CID 15261430) is 2,2-dimethyl-1-phenyl-N-(1-phenylethoxy)propan-1-amine.
What is the SMILES notation for 2,2-dimethyl-1-phenyl-N-(1-phenylethoxy)propan-1-amine?
The canonical SMILES for 2,2-dimethyl-1-phenyl-N-(1-phenylethoxy)propan-1-amine is CC(ONC(c1ccccc1)C(C)(C)C)c1ccccc1.
What is the InChIKey of 2,2-dimethyl-1-phenyl-N-(1-phenylethoxy)propan-1-amine?
The InChIKey is OUBASLZMIDNTBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-15(16-11-7-5-8-12-16)21-20-18(19(2,3)4)17-13-9-6-10-14-17/h5-15,18,20H,1-4H3.
What are the key properties of 2,2-dimethyl-1-phenyl-N-(1-phenylethoxy)propan-1-amine?
2,2-dimethyl-1-phenyl-N-(1-phenylethoxy)propan-1-amine has a molecular weight of 283.42 g/mol, XLogP of 5.06, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-1-phenyl-N-(1-phenylethoxy)propan-1-amine is sourced from PubChem (CID 15261430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).