3-amino-N-(1-hydroxypropan-2-yl)propanamide

C6H14N2O2 — CID 43500124

IUPAC3-amino-N-(1-hydroxypropan-2-yl)propanamide
SMILESCC(CO)NC(=O)CCN
InChIInChI=1S/C6H14N2O2/c1-5(4-9)8-6(10)2-3-7/h5,9H,2-4,7H2,1H3,(H,8,10)
InChIKeyLKJZHVMTBSWYFF-UHFFFAOYSA-N
MW146.19 g/mol
LogP-1.17
Rot. Bonds4

About 3-amino-N-(1-hydroxypropan-2-yl)propanamide

3-amino-N-(1-hydroxypropan-2-yl)propanamide (PubChem CID 43500124) has the molecular formula C6H14N2O2 and a molecular weight of 146.19 g/mol. Its IUPAC name is 3-amino-N-(1-hydroxypropan-2-yl)propanamide.

Molecular Properties

Compound Name3-amino-N-(1-hydroxypropan-2-yl)propanamide
PubChem CID43500124
Molecular FormulaC6H14N2O2
Molecular Weight146.19 g/mol
Exact Mass146.11
IUPAC Name3-amino-N-(1-hydroxypropan-2-yl)propanamide
SMILESCC(CO)NC(=O)CCN
InChIInChI=1S/C6H14N2O2/c1-5(4-9)8-6(10)2-3-7/h5,9H,2-4,7H2,1H3,(H,8,10)
InChIKeyLKJZHVMTBSWYFF-UHFFFAOYSA-N
XLogP-1.17
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 5-1.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-Hydroxybutan-2-yl)acetamide
CID 19845146
Propionylaminoethanol
CID 87536
N-(1,3-dihydroxypropan-2-yl)acetamide
CID 11804802
N,N'-bis(1-hydroxy-3-methylbutan-2-yl)propanediamide
CID 2911778
Propanamide, 3-((2-hydroxyethyl)amino)-
CID 117919
N-glycolyl-2-amino-1-butanol
CID 5232000
N-[(2R)-1-hydroxypropan-2-yl]acetamide
CID 14511499
3-acetamido-N-(2-hydroxyethyl)propanamide
CID 19805630
N-[(2S,3S)-3-hydroxybutan-2-yl]acetamide
CID 54539677
3-butylamino-4-hydroxy-N-butylbutyramide
CID 13512411
(2S)-2-amino-N-(2-hydroxyethyl)propanamide
CID 54557008
N,N'-bis(2-hydroxyethyl)propanediamide
CID 241552

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(1-hydroxypropan-2-yl)propanamide?
The IUPAC name of 3-amino-N-(1-hydroxypropan-2-yl)propanamide (CID 43500124) is 3-amino-N-(1-hydroxypropan-2-yl)propanamide.
What is the SMILES notation for 3-amino-N-(1-hydroxypropan-2-yl)propanamide?
The canonical SMILES for 3-amino-N-(1-hydroxypropan-2-yl)propanamide is CC(CO)NC(=O)CCN.
What is the InChIKey of 3-amino-N-(1-hydroxypropan-2-yl)propanamide?
The InChIKey is LKJZHVMTBSWYFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O2/c1-5(4-9)8-6(10)2-3-7/h5,9H,2-4,7H2,1H3,(H,8,10).
What are the key properties of 3-amino-N-(1-hydroxypropan-2-yl)propanamide?
3-amino-N-(1-hydroxypropan-2-yl)propanamide has a molecular weight of 146.19 g/mol, XLogP of -1.17, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(1-hydroxypropan-2-yl)propanamide is sourced from PubChem (CID 43500124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).