2-[(1-hydroxy-3-phenylpropan-2-yl)amino]-N-methyl-N-propan-2-ylacetamide

C15H24N2O2 — CID 63261635

IUPAC2-[(1-hydroxy-3-phenylpropan-2-yl)amino]-N-methyl-N-propan-2-ylacetamide
SMILESCC(C)N(C)C(=O)CNC(CO)Cc1ccccc1
InChIInChI=1S/C15H24N2O2/c1-12(2)17(3)15(19)10-16-14(11-18)9-13-7-5-4-6-8-13/h4-8,12,14,16,18H,9-11H2,1-3H3
InChIKeyPGFYRWMZVFDGNP-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.05
Rot. Bonds7

About 2-[(1-hydroxy-3-phenylpropan-2-yl)amino]-N-methyl-N-propan-2-ylacetamide

2-[(1-hydroxy-3-phenylpropan-2-yl)amino]-N-methyl-N-propan-2-ylacetamide (PubChem CID 63261635) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-[(1-hydroxy-3-phenylpropan-2-yl)amino]-N-methyl-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[(1-hydroxy-3-phenylpropan-2-yl)amino]-N-methyl-N-propan-2-ylacetamide
PubChem CID63261635
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-[(1-hydroxy-3-phenylpropan-2-yl)amino]-N-methyl-N-propan-2-ylacetamide
SMILESCC(C)N(C)C(=O)CNC(CO)Cc1ccccc1
InChIInChI=1S/C15H24N2O2/c1-12(2)17(3)15(19)10-16-14(11-18)9-13-7-5-4-6-8-13/h4-8,12,14,16,18H,9-11H2,1-3H3
InChIKeyPGFYRWMZVFDGNP-UHFFFAOYSA-N
XLogP1.05
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-(2-methylpropylamino)-3-phenylpropan-1-ol
CID 102610095
2-(butan-2-ylamino)-N-(1-hydroxy-3-phenylpropan-2-yl)acetamide
CID 63261541
(2S)-2-amino-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-3-methylbutanamide
CID 10988719
2-amino-N-(1-hydroxy-3-phenylpropan-2-yl)-3-methylbutanamide
CID 55168250
(2R)-2-amino-N-(1-hydroxy-3-phenylpropan-2-yl)-3-methylbutanamide
CID 79013366
(2R)-3-phenyl-2-(propylamino)propan-1-ol
CID 59859919
1,3-bis(1-hydroxy-3-phenylpropan-2-yl)urea
CID 22088923
2-(3-methylsulfonylpropylamino)-3-phenylpropan-1-ol
CID 55168818
2-(benzylamino)-3-[4-(dimethylamino)phenyl]propan-1-ol
CID 66523313
(2R)-3-phenyl-2-(propan-2-ylsulfamoylamino)propan-1-ol
CID 102675491
3-(dimethylamino)-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]propanamide
CID 107861208
(2S)-3-phenyl-2-(1-phenylpropan-2-ylamino)propan-1-ol
CID 107862363

Frequently Asked Questions

What is the IUPAC name of 2-[(1-hydroxy-3-phenylpropan-2-yl)amino]-N-methyl-N-propan-2-ylacetamide?
The IUPAC name of 2-[(1-hydroxy-3-phenylpropan-2-yl)amino]-N-methyl-N-propan-2-ylacetamide (CID 63261635) is 2-[(1-hydroxy-3-phenylpropan-2-yl)amino]-N-methyl-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[(1-hydroxy-3-phenylpropan-2-yl)amino]-N-methyl-N-propan-2-ylacetamide?
The canonical SMILES for 2-[(1-hydroxy-3-phenylpropan-2-yl)amino]-N-methyl-N-propan-2-ylacetamide is CC(C)N(C)C(=O)CNC(CO)Cc1ccccc1.
What is the InChIKey of 2-[(1-hydroxy-3-phenylpropan-2-yl)amino]-N-methyl-N-propan-2-ylacetamide?
The InChIKey is PGFYRWMZVFDGNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-12(2)17(3)15(19)10-16-14(11-18)9-13-7-5-4-6-8-13/h4-8,12,14,16,18H,9-11H2,1-3H3.
What are the key properties of 2-[(1-hydroxy-3-phenylpropan-2-yl)amino]-N-methyl-N-propan-2-ylacetamide?
2-[(1-hydroxy-3-phenylpropan-2-yl)amino]-N-methyl-N-propan-2-ylacetamide has a molecular weight of 264.37 g/mol, XLogP of 1.05, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-hydroxy-3-phenylpropan-2-yl)amino]-N-methyl-N-propan-2-ylacetamide is sourced from PubChem (CID 63261635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).