N-[(2S)-2-hydroxypropyl]-3-(oxan-2-yl)propanamide

C11H21NO3 — CID 83030976

IUPACN-[(2S)-2-hydroxypropyl]-3-(oxan-2-yl)propanamide
SMILESC[C@H](O)CNC(=O)CCC1CCCCO1
InChIInChI=1S/C11H21NO3/c1-9(13)8-12-11(14)6-5-10-4-2-3-7-15-10/h9-10,13H,2-8H2,1H3,(H,12,14)/t9-,10?/m0/s1
InChIKeyRUEVGMFGESWIPH-RGURZIINSA-N
MW215.29 g/mol
LogP0.83
Rot. Bonds5

About N-[(2S)-2-hydroxypropyl]-3-(oxan-2-yl)propanamide

N-[(2S)-2-hydroxypropyl]-3-(oxan-2-yl)propanamide (PubChem CID 83030976) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is N-[(2S)-2-hydroxypropyl]-3-(oxan-2-yl)propanamide.

Molecular Properties

Compound NameN-[(2S)-2-hydroxypropyl]-3-(oxan-2-yl)propanamide
PubChem CID83030976
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC NameN-[(2S)-2-hydroxypropyl]-3-(oxan-2-yl)propanamide
SMILESC[C@H](O)CNC(=O)CCC1CCCCO1
InChIInChI=1S/C11H21NO3/c1-9(13)8-12-11(14)6-5-10-4-2-3-7-15-10/h9-10,13H,2-8H2,1H3,(H,12,14)/t9-,10?/m0/s1
InChIKeyRUEVGMFGESWIPH-RGURZIINSA-N
XLogP0.83
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2S)-2-hydroxypropyl]-3-[(2R)-oxolan-2-yl]propanamide
CID 93044550
N-[2-methyl-3-(methylamino)propyl]-3-(oxan-2-yl)propanamide
CID 81479192
N-(2-chloropropyl)-3-(oxolan-2-yl)propanamide
CID 114296653
4,4-dimethyl-2-[[3-(oxan-2-yl)propanoylamino]methyl]pentanoic acid
CID 107474137
N-(2-amino-3-hydroxybutyl)-3-(oxolan-2-yl)propanamide
CID 65160397
N-(3-amino-3-hydroxyimino-2-methylpropyl)-3-(oxan-2-yl)propanamide
CID 76996311
N-(2-bromo-2-cyclopropylethyl)-3-(oxan-2-yl)propanamide
CID 114315867
2-hydroxy-3-[3-(oxolan-2-yl)propanoylamino]propanoic acid
CID 66166255
N-[2-(2-chloroethyl)pentyl]-3-(oxan-2-yl)propanamide
CID 106117578
4-hydroxy-N-[2-(oxolan-2-yl)ethyl]pentanamide
CID 79192350
N-(3,3-dimethyl-2-oxobutyl)-3-(oxan-2-yl)propanamide
CID 64991618
N-(1-chloropropan-2-yl)-3-(oxan-2-yl)propanamide
CID 114299597

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-hydroxypropyl]-3-(oxan-2-yl)propanamide?
The IUPAC name of N-[(2S)-2-hydroxypropyl]-3-(oxan-2-yl)propanamide (CID 83030976) is N-[(2S)-2-hydroxypropyl]-3-(oxan-2-yl)propanamide.
What is the SMILES notation for N-[(2S)-2-hydroxypropyl]-3-(oxan-2-yl)propanamide?
The canonical SMILES for N-[(2S)-2-hydroxypropyl]-3-(oxan-2-yl)propanamide is C[C@H](O)CNC(=O)CCC1CCCCO1.
What is the InChIKey of N-[(2S)-2-hydroxypropyl]-3-(oxan-2-yl)propanamide?
The InChIKey is RUEVGMFGESWIPH-RGURZIINSA-N. The full InChI is InChI=1S/C11H21NO3/c1-9(13)8-12-11(14)6-5-10-4-2-3-7-15-10/h9-10,13H,2-8H2,1H3,(H,12,14)/t9-,10?/m0/s1.
What are the key properties of N-[(2S)-2-hydroxypropyl]-3-(oxan-2-yl)propanamide?
N-[(2S)-2-hydroxypropyl]-3-(oxan-2-yl)propanamide has a molecular weight of 215.29 g/mol, XLogP of 0.83, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-hydroxypropyl]-3-(oxan-2-yl)propanamide is sourced from PubChem (CID 83030976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).