4-(3-amino-4-methyl-2-pyridinyl)-3,4-dihydroxybutanamide

C10H15N3O3 — CID 171898847

IUPAC4-(3-amino-4-methyl-2-pyridinyl)-3,4-dihydroxybutanamide
SMILESCc1ccnc(C(O)C(O)CC(N)=O)c1N
InChIInChI=1S/C10H15N3O3/c1-5-2-3-13-9(8(5)12)10(16)6(14)4-7(11)15/h2-3,6,10,14,16H,4,12H2,1H3,(H2,11,15)
InChIKeyZPDVBIDCKHBPKB-UHFFFAOYSA-N
MW225.25 g/mol
LogP-0.76
Rot. Bonds4

About 4-(3-amino-4-methyl-2-pyridinyl)-3,4-dihydroxybutanamide

4-(3-amino-4-methyl-2-pyridinyl)-3,4-dihydroxybutanamide (PubChem CID 171898847) has the molecular formula C10H15N3O3 and a molecular weight of 225.25 g/mol. Its IUPAC name is 4-(3-amino-4-methyl-2-pyridinyl)-3,4-dihydroxybutanamide.

Molecular Properties

Compound Name4-(3-amino-4-methyl-2-pyridinyl)-3,4-dihydroxybutanamide
PubChem CID171898847
Molecular FormulaC10H15N3O3
Molecular Weight225.25 g/mol
Exact Mass225.11
IUPAC Name4-(3-amino-4-methyl-2-pyridinyl)-3,4-dihydroxybutanamide
SMILESCc1ccnc(C(O)C(O)CC(N)=O)c1N
InChIInChI=1S/C10H15N3O3/c1-5-2-3-13-9(8(5)12)10(16)6(14)4-7(11)15/h2-3,6,10,14,16H,4,12H2,1H3,(H2,11,15)
InChIKeyZPDVBIDCKHBPKB-UHFFFAOYSA-N
XLogP-0.76
TPSA122.46 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 5-0.76
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

1-(3-amino-4-methyl-2-pyridinyl)propane-1,2,3-triol
CID 170817535
3,4-dihydroxy-4-(3-hydroxy-2-pyridinyl)butanamide
CID 171898678
4-(2-amino-3-methylphenyl)-3,4-dihydroxybutanamide
CID 171898907
benzyl N-[3-(3-amino-4-methyl-2-pyridinyl)-2,3-dihydroxypropyl]carbamate
CID 171855595
4-(4-amino-3,5-dimethylphenyl)-3,4-dihydroxybutanamide
CID 171899224
4-(3-amino-6-methoxy-2-pyridinyl)-3,4-dihydroxybutanamide
CID 171899177
3,4-dihydroxy-4-[3-(trifluoromethyl)-2-pyridinyl]butanamide
CID 171899581
4-(3-fluoro-6-methyl-2-pyridinyl)-3,4-dihydroxybutanamide
CID 171898885
4-(4,5-diamino-2-methylphenyl)-3,4-dihydroxybutanamide
CID 171899146
4-(2-amino-3,5-dimethylphenyl)-3,4-dihydroxybutanamide
CID 171899222
3,4-dihydroxy-4-(4-hydroxy-2-methylphenyl)butanamide
CID 171898796
4-(4-amino-3-methylphenyl)-3,4-dihydroxybutanamide
CID 171898897

Frequently Asked Questions

What is the IUPAC name of 4-(3-amino-4-methyl-2-pyridinyl)-3,4-dihydroxybutanamide?
The IUPAC name of 4-(3-amino-4-methyl-2-pyridinyl)-3,4-dihydroxybutanamide (CID 171898847) is 4-(3-amino-4-methyl-2-pyridinyl)-3,4-dihydroxybutanamide.
What is the SMILES notation for 4-(3-amino-4-methyl-2-pyridinyl)-3,4-dihydroxybutanamide?
The canonical SMILES for 4-(3-amino-4-methyl-2-pyridinyl)-3,4-dihydroxybutanamide is Cc1ccnc(C(O)C(O)CC(N)=O)c1N.
What is the InChIKey of 4-(3-amino-4-methyl-2-pyridinyl)-3,4-dihydroxybutanamide?
The InChIKey is ZPDVBIDCKHBPKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3/c1-5-2-3-13-9(8(5)12)10(16)6(14)4-7(11)15/h2-3,6,10,14,16H,4,12H2,1H3,(H2,11,15).
What are the key properties of 4-(3-amino-4-methyl-2-pyridinyl)-3,4-dihydroxybutanamide?
4-(3-amino-4-methyl-2-pyridinyl)-3,4-dihydroxybutanamide has a molecular weight of 225.25 g/mol, XLogP of -0.76, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-amino-4-methyl-2-pyridinyl)-3,4-dihydroxybutanamide is sourced from PubChem (CID 171898847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).