(2S)-2-hydroxy-3-pyrrolidin-1-ylpropanamide

C7H14N2O2 — CID 139994920

IUPAC(2S)-2-hydroxy-3-pyrrolidin-1-ylpropanamide
SMILESNC(=O)[C@@H](O)CN1CCCC1
InChIInChI=1S/C7H14N2O2/c8-7(11)6(10)5-9-3-1-2-4-9/h6,10H,1-5H2,(H2,8,11)/t6-/m0/s1
InChIKeyHLXBRPSKXCNWMZ-LURJTMIESA-N
MW158.20 g/mol
LogP-1.07
Rot. Bonds3

About (2S)-2-hydroxy-3-pyrrolidin-1-ylpropanamide

(2S)-2-hydroxy-3-pyrrolidin-1-ylpropanamide (PubChem CID 139994920) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is (2S)-2-hydroxy-3-pyrrolidin-1-ylpropanamide.

Molecular Properties

Compound Name(2S)-2-hydroxy-3-pyrrolidin-1-ylpropanamide
PubChem CID139994920
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC Name(2S)-2-hydroxy-3-pyrrolidin-1-ylpropanamide
SMILESNC(=O)[C@@H](O)CN1CCCC1
InChIInChI=1S/C7H14N2O2/c8-7(11)6(10)5-9-3-1-2-4-9/h6,10H,1-5H2,(H2,8,11)/t6-/m0/s1
InChIKeyHLXBRPSKXCNWMZ-LURJTMIESA-N
XLogP-1.07
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-1.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 130593606
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CID 106172340
1,3-dipyrrolidin-1-ylpropan-2-ol
CID 57126359
2-hydroxy-1-[4-(2-hydroxy-4-methyl-3-oxopentyl)-1,4-diazepan-1-yl]-4-methylpentan-3-one
CID 86764694
2-hydroxy-3-(3-propylazetidin-1-yl)propanamide
CID 106172316
3-(2,6-dioxopiperidin-1-yl)-2-hydroxypropanamide
CID 106172345
4-(azepan-1-yl)-3-hydroxybutanoic acid
CID 82774888
(2S)-1-amino-3-(azonan-1-yl)propan-2-ol
CID 131048167
1-amino-3-(azonan-1-yl)propan-2-ol
CID 127001298
(2R)-3-(2-ethylpyrrolidin-1-yl)-2-hydroxypropanamide
CID 69367604
oxalic acid;platinum;1-pyrrolidin-1-ylpropan-2-amine
CID 88639332

Frequently Asked Questions

What is the IUPAC name of (2S)-2-hydroxy-3-pyrrolidin-1-ylpropanamide?
The IUPAC name of (2S)-2-hydroxy-3-pyrrolidin-1-ylpropanamide (CID 139994920) is (2S)-2-hydroxy-3-pyrrolidin-1-ylpropanamide.
What is the SMILES notation for (2S)-2-hydroxy-3-pyrrolidin-1-ylpropanamide?
The canonical SMILES for (2S)-2-hydroxy-3-pyrrolidin-1-ylpropanamide is NC(=O)[C@@H](O)CN1CCCC1.
What is the InChIKey of (2S)-2-hydroxy-3-pyrrolidin-1-ylpropanamide?
The InChIKey is HLXBRPSKXCNWMZ-LURJTMIESA-N. The full InChI is InChI=1S/C7H14N2O2/c8-7(11)6(10)5-9-3-1-2-4-9/h6,10H,1-5H2,(H2,8,11)/t6-/m0/s1.
What are the key properties of (2S)-2-hydroxy-3-pyrrolidin-1-ylpropanamide?
(2S)-2-hydroxy-3-pyrrolidin-1-ylpropanamide has a molecular weight of 158.20 g/mol, XLogP of -1.07, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-hydroxy-3-pyrrolidin-1-ylpropanamide is sourced from PubChem (CID 139994920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).