N-(2-hydroxypropyl)-N,3-dimethyl-2-phenylpentanamide

C16H25NO2 — CID 62335322

IUPACN-(2-hydroxypropyl)-N,3-dimethyl-2-phenylpentanamide
SMILESCCC(C)C(C(=O)N(C)CC(C)O)c1ccccc1
InChIInChI=1S/C16H25NO2/c1-5-12(2)15(14-9-7-6-8-10-14)16(19)17(4)11-13(3)18/h6-10,12-13,15,18H,5,11H2,1-4H3
InChIKeyVKPZUMKQHJOQQS-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.66
Rot. Bonds6

About N-(2-hydroxypropyl)-N,3-dimethyl-2-phenylpentanamide

N-(2-hydroxypropyl)-N,3-dimethyl-2-phenylpentanamide (PubChem CID 62335322) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is N-(2-hydroxypropyl)-N,3-dimethyl-2-phenylpentanamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)-N,3-dimethyl-2-phenylpentanamide
PubChem CID62335322
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC NameN-(2-hydroxypropyl)-N,3-dimethyl-2-phenylpentanamide
SMILESCCC(C)C(C(=O)N(C)CC(C)O)c1ccccc1
InChIInChI=1S/C16H25NO2/c1-5-12(2)15(14-9-7-6-8-10-14)16(19)17(4)11-13(3)18/h6-10,12-13,15,18H,5,11H2,1-4H3
InChIKeyVKPZUMKQHJOQQS-UHFFFAOYSA-N
XLogP2.66
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromoethyl)-N,3-dimethyl-2-phenylpentanamide
CID 80658652
3-[methyl-(3-methyl-2-phenylpentanoyl)amino]propanoic acid
CID 60990079
N-(5-chloropentyl)-N,3-dimethyl-2-phenylpentanamide
CID 107205692
(2S)-2-amino-N-(2-hydroxypropyl)-N-methyl-2-phenylacetamide
CID 104897800
N-(2-hydroxypropyl)-N-methyl-2-phenoxybutanamide
CID 62332724
2-[ethyl-(3-methyl-2-phenylpentanoyl)amino]acetic acid
CID 61021604
tert-butyl 3-methyl-2-phenylpentanoate
CID 63896641
N,3-dimethyl-2-phenyl-N-piperidin-4-ylpentanamide
CID 43602183
5-methyl-4-phenylhept-1-yn-3-one
CID 114978498
(2S,3S)-2-amino-N,3-dimethyl-N-(1-phenylethyl)pentanamide
CID 61164093
N-cyclobutyl-N-(2-hydroxyethyl)-3-methyl-2-phenylpentanamide
CID 102867408
N-(1,3-dihydroxypropan-2-yl)-3-methyl-2-phenylpentanamide
CID 65315116

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypropyl)-N,3-dimethyl-2-phenylpentanamide?
The IUPAC name of N-(2-hydroxypropyl)-N,3-dimethyl-2-phenylpentanamide (CID 62335322) is N-(2-hydroxypropyl)-N,3-dimethyl-2-phenylpentanamide.
What is the SMILES notation for N-(2-hydroxypropyl)-N,3-dimethyl-2-phenylpentanamide?
The canonical SMILES for N-(2-hydroxypropyl)-N,3-dimethyl-2-phenylpentanamide is CCC(C)C(C(=O)N(C)CC(C)O)c1ccccc1.
What is the InChIKey of N-(2-hydroxypropyl)-N,3-dimethyl-2-phenylpentanamide?
The InChIKey is VKPZUMKQHJOQQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-5-12(2)15(14-9-7-6-8-10-14)16(19)17(4)11-13(3)18/h6-10,12-13,15,18H,5,11H2,1-4H3.
What are the key properties of N-(2-hydroxypropyl)-N,3-dimethyl-2-phenylpentanamide?
N-(2-hydroxypropyl)-N,3-dimethyl-2-phenylpentanamide has a molecular weight of 263.38 g/mol, XLogP of 2.66, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypropyl)-N,3-dimethyl-2-phenylpentanamide is sourced from PubChem (CID 62335322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).