N-(2-amino-3-hydroxybutyl)-3-(oxolan-2-yl)propanamide

C11H22N2O3 — CID 65160397

IUPACN-(2-amino-3-hydroxybutyl)-3-(oxolan-2-yl)propanamide
SMILESCC(O)C(N)CNC(=O)CCC1CCCO1
InChIInChI=1S/C11H22N2O3/c1-8(14)10(12)7-13-11(15)5-4-9-3-2-6-16-9/h8-10,14H,2-7,12H2,1H3,(H,13,15)
InChIKeyQLORXYHCRGZJGE-UHFFFAOYSA-N
MW230.31 g/mol
LogP-0.23
Rot. Bonds6

About N-(2-amino-3-hydroxybutyl)-3-(oxolan-2-yl)propanamide

N-(2-amino-3-hydroxybutyl)-3-(oxolan-2-yl)propanamide (PubChem CID 65160397) has the molecular formula C11H22N2O3 and a molecular weight of 230.31 g/mol. Its IUPAC name is N-(2-amino-3-hydroxybutyl)-3-(oxolan-2-yl)propanamide.

Molecular Properties

Compound NameN-(2-amino-3-hydroxybutyl)-3-(oxolan-2-yl)propanamide
PubChem CID65160397
Molecular FormulaC11H22N2O3
Molecular Weight230.31 g/mol
Exact Mass230.16
IUPAC NameN-(2-amino-3-hydroxybutyl)-3-(oxolan-2-yl)propanamide
SMILESCC(O)C(N)CNC(=O)CCC1CCCO1
InChIInChI=1S/C11H22N2O3/c1-8(14)10(12)7-13-11(15)5-4-9-3-2-6-16-9/h8-10,14H,2-7,12H2,1H3,(H,13,15)
InChIKeyQLORXYHCRGZJGE-UHFFFAOYSA-N
XLogP-0.23
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 5-0.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-(2-amino-3-hydroxybutyl)-3-(oxolan-2-yl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2S)-2-hydroxypropyl]-3-[(2R)-oxolan-2-yl]propanamide
CID 93044550
N-(2-chloropropyl)-3-(oxolan-2-yl)propanamide
CID 114296653
N-[(2S)-2-hydroxypropyl]-3-(oxan-2-yl)propanamide
CID 83030976
2-hydroxy-3-[3-(oxolan-2-yl)propanoylamino]propanoic acid
CID 66166255
N-(2-amino-3-hydroxybutyl)-3-cyclohexylpropanamide
CID 64541698
N-[2-methyl-3-(methylamino)propyl]-3-(oxan-2-yl)propanamide
CID 81479192
N-(3-amino-3-hydroxyimino-2-methylpropyl)-3-(oxan-2-yl)propanamide
CID 76996311
4-hydroxy-N-[2-(oxolan-2-yl)ethyl]pentanamide
CID 79192350
N-(2-hydroxyethyl)-3-(oxolan-2-yl)propanamide
CID 43419593
N-[(2S)-2-(4-methylphenoxy)propyl]-3-[(2R)-oxolan-2-yl]propanamide
CID 96566487
N-(2-bromo-2-cyclopropylethyl)-3-(oxan-2-yl)propanamide
CID 114315867
4,4-dimethyl-2-[[3-(oxan-2-yl)propanoylamino]methyl]pentanoic acid
CID 107474137

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-3-hydroxybutyl)-3-(oxolan-2-yl)propanamide?
The IUPAC name of N-(2-amino-3-hydroxybutyl)-3-(oxolan-2-yl)propanamide (CID 65160397) is N-(2-amino-3-hydroxybutyl)-3-(oxolan-2-yl)propanamide.
What is the SMILES notation for N-(2-amino-3-hydroxybutyl)-3-(oxolan-2-yl)propanamide?
The canonical SMILES for N-(2-amino-3-hydroxybutyl)-3-(oxolan-2-yl)propanamide is CC(O)C(N)CNC(=O)CCC1CCCO1.
What is the InChIKey of N-(2-amino-3-hydroxybutyl)-3-(oxolan-2-yl)propanamide?
The InChIKey is QLORXYHCRGZJGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3/c1-8(14)10(12)7-13-11(15)5-4-9-3-2-6-16-9/h8-10,14H,2-7,12H2,1H3,(H,13,15).
What are the key properties of N-(2-amino-3-hydroxybutyl)-3-(oxolan-2-yl)propanamide?
N-(2-amino-3-hydroxybutyl)-3-(oxolan-2-yl)propanamide has a molecular weight of 230.31 g/mol, XLogP of -0.23, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-3-hydroxybutyl)-3-(oxolan-2-yl)propanamide is sourced from PubChem (CID 65160397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).