2-phenyl-N-[(2-propan-2-yloxyphenyl)methyl]propan-1-amine

C19H25NO — CID 43221119

IUPAC2-phenyl-N-[(2-propan-2-yloxyphenyl)methyl]propan-1-amine
SMILESCC(C)Oc1ccccc1CNCC(C)c1ccccc1
InChIInChI=1S/C19H25NO/c1-15(2)21-19-12-8-7-11-18(19)14-20-13-16(3)17-9-5-4-6-10-17/h4-12,15-16,20H,13-14H2,1-3H3
InChIKeyKXFDCHKITKXSKH-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.37
Rot. Bonds7

About 2-phenyl-N-[(2-propan-2-yloxyphenyl)methyl]propan-1-amine

2-phenyl-N-[(2-propan-2-yloxyphenyl)methyl]propan-1-amine (PubChem CID 43221119) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 2-phenyl-N-[(2-propan-2-yloxyphenyl)methyl]propan-1-amine.

Molecular Properties

Compound Name2-phenyl-N-[(2-propan-2-yloxyphenyl)methyl]propan-1-amine
PubChem CID43221119
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name2-phenyl-N-[(2-propan-2-yloxyphenyl)methyl]propan-1-amine
SMILESCC(C)Oc1ccccc1CNCC(C)c1ccccc1
InChIInChI=1S/C19H25NO/c1-15(2)21-19-12-8-7-11-18(19)14-20-13-16(3)17-9-5-4-6-10-17/h4-12,15-16,20H,13-14H2,1-3H3
InChIKeyKXFDCHKITKXSKH-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

Analyze 2-phenyl-N-[(2-propan-2-yloxyphenyl)methyl]propan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-1-[(2-propan-2-yloxyphenyl)methylamino]propan-2-ol
CID 51675528
2-phenyl-N-[(2-prop-2-ynoxyphenyl)methyl]propan-1-amine
CID 43078385
N-[(2-propan-2-yloxyphenyl)methyl]-2-(1,3-thiazol-2-yl)propan-1-amine
CID 104588784
1-phenyl-1-phosphanyl-N-[(2-propan-2-yloxyphenyl)methyl]methanamine
CID 176995355
N-[(2-propan-2-yloxyphenyl)methyl]-2-pyrrolidin-1-ylpropan-1-amine
CID 112727650
(2R)-2-phenyl-N-[(2S)-2-phenylpropyl]propan-1-amine
CID 7054159
3-phenyl-N-[(2-propan-2-yloxyphenyl)methyl]propan-1-amine
CID 43220682
3-fluoro-N-[(2-propan-2-yloxyphenyl)methyl]propan-1-amine
CID 115733033
2-methyl-N-[(2-propan-2-yloxyphenyl)methyl]prop-2-en-1-amine
CID 114615444
(2R)-1-[[2-(difluoromethoxy)phenyl]methylamino]propan-2-ol
CID 93033134
1-(2-propan-2-yloxyphenyl)-N-(pyridin-2-ylmethyl)methanamine
CID 39358305
N-[(2-bromo-5-fluorophenyl)methyl]-2-phenylpropan-1-amine
CID 63452893

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-[(2-propan-2-yloxyphenyl)methyl]propan-1-amine?
The IUPAC name of 2-phenyl-N-[(2-propan-2-yloxyphenyl)methyl]propan-1-amine (CID 43221119) is 2-phenyl-N-[(2-propan-2-yloxyphenyl)methyl]propan-1-amine.
What is the SMILES notation for 2-phenyl-N-[(2-propan-2-yloxyphenyl)methyl]propan-1-amine?
The canonical SMILES for 2-phenyl-N-[(2-propan-2-yloxyphenyl)methyl]propan-1-amine is CC(C)Oc1ccccc1CNCC(C)c1ccccc1.
What is the InChIKey of 2-phenyl-N-[(2-propan-2-yloxyphenyl)methyl]propan-1-amine?
The InChIKey is KXFDCHKITKXSKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-15(2)21-19-12-8-7-11-18(19)14-20-13-16(3)17-9-5-4-6-10-17/h4-12,15-16,20H,13-14H2,1-3H3.
What are the key properties of 2-phenyl-N-[(2-propan-2-yloxyphenyl)methyl]propan-1-amine?
2-phenyl-N-[(2-propan-2-yloxyphenyl)methyl]propan-1-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 2-phenyl-N-[(2-propan-2-yloxyphenyl)methyl]propan-1-amine is sourced from PubChem (CID 43221119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).