N-[3-(6-amino-2-methyl-3-pyridinyl)-2,3-dihydroxypropyl]acetamide

C11H17N3O3 — CID 170829714

IUPACN-[3-(6-amino-2-methyl-3-pyridinyl)-2,3-dihydroxypropyl]acetamide
SMILESCC(=O)NCC(O)C(O)c1ccc(N)nc1C
InChIInChI=1S/C11H17N3O3/c1-6-8(3-4-10(12)14-6)11(17)9(16)5-13-7(2)15/h3-4,9,11,16-17H,5H2,1-2H3,(H2,12,14)(H,13,15)
InChIKeyHXOMZYWXXIKKHW-UHFFFAOYSA-N
MW239.27 g/mol
LogP-0.50
Rot. Bonds4

About N-[3-(6-amino-2-methyl-3-pyridinyl)-2,3-dihydroxypropyl]acetamide

N-[3-(6-amino-2-methyl-3-pyridinyl)-2,3-dihydroxypropyl]acetamide (PubChem CID 170829714) has the molecular formula C11H17N3O3 and a molecular weight of 239.27 g/mol. Its IUPAC name is N-[3-(6-amino-2-methyl-3-pyridinyl)-2,3-dihydroxypropyl]acetamide.

Molecular Properties

Compound NameN-[3-(6-amino-2-methyl-3-pyridinyl)-2,3-dihydroxypropyl]acetamide
PubChem CID170829714
Molecular FormulaC11H17N3O3
Molecular Weight239.27 g/mol
Exact Mass239.13
IUPAC NameN-[3-(6-amino-2-methyl-3-pyridinyl)-2,3-dihydroxypropyl]acetamide
SMILESCC(=O)NCC(O)C(O)c1ccc(N)nc1C
InChIInChI=1S/C11H17N3O3/c1-6-8(3-4-10(12)14-6)11(17)9(16)5-13-7(2)15/h3-4,9,11,16-17H,5H2,1-2H3,(H2,12,14)(H,13,15)
InChIKeyHXOMZYWXXIKKHW-UHFFFAOYSA-N
XLogP-0.50
TPSA108.47 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 5-0.50
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(4-amino-2-fluoro-3-methylphenyl)-2,3-dihydroxypropyl]acetamide
CID 170830083
N-[5-[1,2-dihydroxy-3-(methylamino)propyl]-6-methyl-2-pyridinyl]acetamide
CID 171858585
N-[3-(4-aminophenyl)-2,3-dihydroxypropyl]acetamide
CID 170829554
N-[3-(4-bromo-2-methylphenyl)-2,3-dihydroxypropyl]acetamide
CID 170831127
N-[3-(5-amino-1H-pyrazol-4-yl)-2,3-dihydroxypropyl]acetamide
CID 170829471
N-[2,3-dihydroxy-3-(2-methyl-6-oxo-1H-pyridin-3-yl)propyl]acetamide
CID 170829833
N-[6-methyl-5-(1,2,3-trihydroxypropyl)-2-pyridinyl]acetamide
CID 170818483
N-[3-(3-fluoro-4-pyridinyl)-2,3-dihydroxypropyl]acetamide
CID 170829540
N-[3-(6-chloro-2-methyl-5-nitro-3-pyridinyl)-2,3-dihydroxypropyl]acetamide
CID 170830684
N-[3-(2,4-dimethyl-1,3-thiazol-5-yl)-2,3-dihydroxypropyl]acetamide
CID 170829536
N-[3-(5-amino-2,4-difluorophenyl)-2,3-dihydroxypropyl]acetamide
CID 170830125
N-[3-(2-amino-5-methoxyphenyl)-2,3-dihydroxypropyl]acetamide
CID 170830174

Frequently Asked Questions

What is the IUPAC name of N-[3-(6-amino-2-methyl-3-pyridinyl)-2,3-dihydroxypropyl]acetamide?
The IUPAC name of N-[3-(6-amino-2-methyl-3-pyridinyl)-2,3-dihydroxypropyl]acetamide (CID 170829714) is N-[3-(6-amino-2-methyl-3-pyridinyl)-2,3-dihydroxypropyl]acetamide.
What is the SMILES notation for N-[3-(6-amino-2-methyl-3-pyridinyl)-2,3-dihydroxypropyl]acetamide?
The canonical SMILES for N-[3-(6-amino-2-methyl-3-pyridinyl)-2,3-dihydroxypropyl]acetamide is CC(=O)NCC(O)C(O)c1ccc(N)nc1C.
What is the InChIKey of N-[3-(6-amino-2-methyl-3-pyridinyl)-2,3-dihydroxypropyl]acetamide?
The InChIKey is HXOMZYWXXIKKHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3/c1-6-8(3-4-10(12)14-6)11(17)9(16)5-13-7(2)15/h3-4,9,11,16-17H,5H2,1-2H3,(H2,12,14)(H,13,15).
What are the key properties of N-[3-(6-amino-2-methyl-3-pyridinyl)-2,3-dihydroxypropyl]acetamide?
N-[3-(6-amino-2-methyl-3-pyridinyl)-2,3-dihydroxypropyl]acetamide has a molecular weight of 239.27 g/mol, XLogP of -0.50, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(6-amino-2-methyl-3-pyridinyl)-2,3-dihydroxypropyl]acetamide is sourced from PubChem (CID 170829714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).