N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-pyridin-2-ylacetamide

C11H16N2O4 — CID 107845294

IUPACN-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-pyridin-2-ylacetamide
SMILESO=C(Cc1ccccn1)NC(CO)(CO)CO
InChIInChI=1S/C11H16N2O4/c14-6-11(7-15,8-16)13-10(17)5-9-3-1-2-4-12-9/h1-4,14-16H,5-8H2,(H,13,17)
InChIKeyQOZHCGFBPRPOIH-UHFFFAOYSA-N
MW240.26 g/mol
LogP-1.54
Rot. Bonds6

About N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-pyridin-2-ylacetamide

N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-pyridin-2-ylacetamide (PubChem CID 107845294) has the molecular formula C11H16N2O4 and a molecular weight of 240.26 g/mol. Its IUPAC name is N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-pyridin-2-ylacetamide.

Molecular Properties

Compound NameN-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-pyridin-2-ylacetamide
PubChem CID107845294
Molecular FormulaC11H16N2O4
Molecular Weight240.26 g/mol
Exact Mass240.11
IUPAC NameN-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-pyridin-2-ylacetamide
SMILESO=C(Cc1ccccn1)NC(CO)(CO)CO
InChIInChI=1S/C11H16N2O4/c14-6-11(7-15,8-16)13-10(17)5-9-3-1-2-4-12-9/h1-4,14-16H,5-8H2,(H,13,17)
InChIKeyQOZHCGFBPRPOIH-UHFFFAOYSA-N
XLogP-1.54
TPSA102.68 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 5-1.54
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,2-difluoro-3-hydroxypropyl)-2-pyridin-2-ylacetamide
CID 106168483
N-[2-ethyl-2-(hydroxymethyl)butyl]-2-pyridin-2-ylacetamide
CID 106252214
2-[4-[4-[[bis(pyridin-2-ylmethyl)amino]methyl]-1H-diazet-2-yl]phenyl]-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]acetamide
CID 166650707
N-phenyl-2-pyridin-2-ylacetamide chloride
CID 21234777
ethyl 2-[(2-pyridin-2-ylacetyl)amino]acetate
CID 55026375
N-(2-hydroxyphenyl)-2-pyridin-2-ylacetamide
CID 11746373
N-(4-hydroxybutan-2-yl)-2-pyridin-2-ylacetamide
CID 83188668
N-[2-(propan-2-ylamino)ethyl]-2-pyridin-2-ylacetamide
CID 62658246
N-(3-hydroxy-2-methylpropyl)-2-pyridin-2-ylacetamide
CID 65037494
N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-pyridin-2-ylacetamide
CID 79246224
CID 131857449
CID 131857449
N-(2-methyl-3-nitrophenyl)-2-pyridin-2-ylacetamide
CID 110468233

Frequently Asked Questions

What is the IUPAC name of N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-pyridin-2-ylacetamide?
The IUPAC name of N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-pyridin-2-ylacetamide (CID 107845294) is N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-pyridin-2-ylacetamide.
What is the SMILES notation for N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-pyridin-2-ylacetamide?
The canonical SMILES for N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-pyridin-2-ylacetamide is O=C(Cc1ccccn1)NC(CO)(CO)CO.
What is the InChIKey of N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-pyridin-2-ylacetamide?
The InChIKey is QOZHCGFBPRPOIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O4/c14-6-11(7-15,8-16)13-10(17)5-9-3-1-2-4-12-9/h1-4,14-16H,5-8H2,(H,13,17).
What are the key properties of N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-pyridin-2-ylacetamide?
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-pyridin-2-ylacetamide has a molecular weight of 240.26 g/mol, XLogP of -1.54, 6 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-pyridin-2-ylacetamide is sourced from PubChem (CID 107845294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).