N-(1-hydroxypropan-2-yl)-N-methyl-2-naphthalen-2-ylacetamide

C16H19NO2 — CID 115765000

IUPACN-(1-hydroxypropan-2-yl)-N-methyl-2-naphthalen-2-ylacetamide
SMILESCC(CO)N(C)C(=O)Cc1ccc2ccccc2c1
InChIInChI=1S/C16H19NO2/c1-12(11-18)17(2)16(19)10-13-7-8-14-5-3-4-6-15(14)9-13/h3-9,12,18H,10-11H2,1-2H3
InChIKeyIHPVTFNMBROZHY-UHFFFAOYSA-N
MW257.33 g/mol
LogP2.22
Rot. Bonds4

About N-(1-hydroxypropan-2-yl)-N-methyl-2-naphthalen-2-ylacetamide

N-(1-hydroxypropan-2-yl)-N-methyl-2-naphthalen-2-ylacetamide (PubChem CID 115765000) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is N-(1-hydroxypropan-2-yl)-N-methyl-2-naphthalen-2-ylacetamide.

Molecular Properties

Compound NameN-(1-hydroxypropan-2-yl)-N-methyl-2-naphthalen-2-ylacetamide
PubChem CID115765000
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC NameN-(1-hydroxypropan-2-yl)-N-methyl-2-naphthalen-2-ylacetamide
SMILESCC(CO)N(C)C(=O)Cc1ccc2ccccc2c1
InChIInChI=1S/C16H19NO2/c1-12(11-18)17(2)16(19)10-13-7-8-14-5-3-4-6-15(14)9-13/h3-9,12,18H,10-11H2,1-2H3
InChIKeyIHPVTFNMBROZHY-UHFFFAOYSA-N
XLogP2.22
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-hydroxypropan-2-yl)-2-(3-methoxyphenyl)-N-methylacetamide
CID 113337596
2-[methyl-(2-naphthalen-2-ylacetyl)amino]acetic acid
CID 18071237
2-(4-hydroxyphenyl)-N-(1-hydroxypropan-2-yl)-N-methylacetamide
CID 115869468
2-(2,3-dihydro-1H-inden-5-yl)-N-(1-hydroxypropan-2-yl)-N-methylacetamide
CID 112548127
2-(4-chlorophenyl)-N-(1-hydroxypropan-2-yl)-N-methylacetamide
CID 115765069
N-(2-cyanopropyl)-N-methyl-2-naphthalen-2-ylacetamide
CID 47402323
N-(2-bromoethyl)-N-methyl-2-naphthalen-2-ylacetamide
CID 80658951
N-(2-aminoethyl)-N-methyl-2-naphthalen-2-ylacetamide
CID 55149469
N-(1-aminopropan-2-yl)-N-methyl-3-naphthalen-2-ylpropanamide;hydrochloride
CID 119584639
2-[ethyl-(2-naphthalen-2-ylacetyl)amino]acetic acid
CID 61021983
2-methyl-2-[methyl-(2-naphthalen-2-ylacetyl)amino]propanoic acid
CID 62817552
2-(4-carbamothioylphenyl)-N-(1-hydroxypropan-2-yl)-N-methylacetamide
CID 104551988

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxypropan-2-yl)-N-methyl-2-naphthalen-2-ylacetamide?
The IUPAC name of N-(1-hydroxypropan-2-yl)-N-methyl-2-naphthalen-2-ylacetamide (CID 115765000) is N-(1-hydroxypropan-2-yl)-N-methyl-2-naphthalen-2-ylacetamide.
What is the SMILES notation for N-(1-hydroxypropan-2-yl)-N-methyl-2-naphthalen-2-ylacetamide?
The canonical SMILES for N-(1-hydroxypropan-2-yl)-N-methyl-2-naphthalen-2-ylacetamide is CC(CO)N(C)C(=O)Cc1ccc2ccccc2c1.
What is the InChIKey of N-(1-hydroxypropan-2-yl)-N-methyl-2-naphthalen-2-ylacetamide?
The InChIKey is IHPVTFNMBROZHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-12(11-18)17(2)16(19)10-13-7-8-14-5-3-4-6-15(14)9-13/h3-9,12,18H,10-11H2,1-2H3.
What are the key properties of N-(1-hydroxypropan-2-yl)-N-methyl-2-naphthalen-2-ylacetamide?
N-(1-hydroxypropan-2-yl)-N-methyl-2-naphthalen-2-ylacetamide has a molecular weight of 257.33 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxypropan-2-yl)-N-methyl-2-naphthalen-2-ylacetamide is sourced from PubChem (CID 115765000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).