3-amino-2-methyl-3-phenyl-N-(4-propan-2-yloxyphenyl)propanamide

C19H24N2O2 — CID 119707089

IUPAC3-amino-2-methyl-3-phenyl-N-(4-propan-2-yloxyphenyl)propanamide
SMILESCC(C)Oc1ccc(NC(=O)C(C)C(N)c2ccccc2)cc1
InChIInChI=1S/C19H24N2O2/c1-13(2)23-17-11-9-16(10-12-17)21-19(22)14(3)18(20)15-7-5-4-6-8-15/h4-14,18H,20H2,1-3H3,(H,21,22)
InChIKeyFENGFSCOANXMNX-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.75
Rot. Bonds6

About 3-amino-2-methyl-3-phenyl-N-(4-propan-2-yloxyphenyl)propanamide

3-amino-2-methyl-3-phenyl-N-(4-propan-2-yloxyphenyl)propanamide (PubChem CID 119707089) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 3-amino-2-methyl-3-phenyl-N-(4-propan-2-yloxyphenyl)propanamide.

Molecular Properties

Compound Name3-amino-2-methyl-3-phenyl-N-(4-propan-2-yloxyphenyl)propanamide
PubChem CID119707089
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name3-amino-2-methyl-3-phenyl-N-(4-propan-2-yloxyphenyl)propanamide
SMILESCC(C)Oc1ccc(NC(=O)C(C)C(N)c2ccccc2)cc1
InChIInChI=1S/C19H24N2O2/c1-13(2)23-17-11-9-16(10-12-17)21-19(22)14(3)18(20)15-7-5-4-6-8-15/h4-14,18H,20H2,1-3H3,(H,21,22)
InChIKeyFENGFSCOANXMNX-UHFFFAOYSA-N
XLogP3.75
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-hydroxy-2-phenyl-N-(4-propan-2-yloxyphenyl)acetamide
CID 110896061
3-amino-N-(4-ethylphenyl)-2-methyl-3-phenylpropanamide
CID 80546370
3-amino-N-(3,5-dimethoxyphenyl)-2-methyl-3-phenylpropanamide
CID 119673892
2-amino-3-methyl-N-(4-propan-2-yloxyphenyl)butanamide;hydrochloride
CID 119280468
3-amino-N-(3,4-dimethoxyphenyl)-2-methyl-3-phenylpropanamide
CID 119673644
3-amino-2-methyl-N-[4-(methylsulfanylmethyl)phenyl]-3-phenylpropanamide
CID 119769536
(2R)-2-hydroxy-N-(4-propan-2-yloxyphenyl)propanamide
CID 94684359
2-amino-3,3-dimethyl-N-(4-propan-2-yloxyphenyl)butanamide
CID 76892558
3-amino-N-(3,5-dimethylphenyl)-2-methyl-3-phenylpropanamide;hydrochloride
CID 119673932
(2S)-2-amino-4-methyl-N-(4-propan-2-yloxyphenyl)pentanamide
CID 22691065
3-amino-N-carbamoyl-2-methyl-3-phenylpropanamide
CID 80552689
3-amino-N-(3-hydroxy-4-methylphenyl)-2-methyl-3-phenylpropanamide
CID 107701634

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-methyl-3-phenyl-N-(4-propan-2-yloxyphenyl)propanamide?
The IUPAC name of 3-amino-2-methyl-3-phenyl-N-(4-propan-2-yloxyphenyl)propanamide (CID 119707089) is 3-amino-2-methyl-3-phenyl-N-(4-propan-2-yloxyphenyl)propanamide.
What is the SMILES notation for 3-amino-2-methyl-3-phenyl-N-(4-propan-2-yloxyphenyl)propanamide?
The canonical SMILES for 3-amino-2-methyl-3-phenyl-N-(4-propan-2-yloxyphenyl)propanamide is CC(C)Oc1ccc(NC(=O)C(C)C(N)c2ccccc2)cc1.
What is the InChIKey of 3-amino-2-methyl-3-phenyl-N-(4-propan-2-yloxyphenyl)propanamide?
The InChIKey is FENGFSCOANXMNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-13(2)23-17-11-9-16(10-12-17)21-19(22)14(3)18(20)15-7-5-4-6-8-15/h4-14,18H,20H2,1-3H3,(H,21,22).
What are the key properties of 3-amino-2-methyl-3-phenyl-N-(4-propan-2-yloxyphenyl)propanamide?
3-amino-2-methyl-3-phenyl-N-(4-propan-2-yloxyphenyl)propanamide has a molecular weight of 312.41 g/mol, XLogP of 3.75, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-methyl-3-phenyl-N-(4-propan-2-yloxyphenyl)propanamide is sourced from PubChem (CID 119707089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).