2-amino-N-(3-methyl-2-pyridinyl)propanamide

C9H13N3O — CID 60731979

IUPAC2-amino-N-(3-methyl-2-pyridinyl)propanamide
SMILESCc1cccnc1NC(=O)C(C)N
InChIInChI=1S/C9H13N3O/c1-6-4-3-5-11-8(6)12-9(13)7(2)10/h3-5,7H,10H2,1-2H3,(H,11,12,13)
InChIKeyROCCVOGJWLBQOP-UHFFFAOYSA-N
MW179.22 g/mol
LogP0.68
Rot. Bonds2

About 2-amino-N-(3-methyl-2-pyridinyl)propanamide

2-amino-N-(3-methyl-2-pyridinyl)propanamide (PubChem CID 60731979) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is 2-amino-N-(3-methyl-2-pyridinyl)propanamide.

Molecular Properties

Compound Name2-amino-N-(3-methyl-2-pyridinyl)propanamide
PubChem CID60731979
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC Name2-amino-N-(3-methyl-2-pyridinyl)propanamide
SMILESCc1cccnc1NC(=O)C(C)N
InChIInChI=1S/C9H13N3O/c1-6-4-3-5-11-8(6)12-9(13)7(2)10/h3-5,7H,10H2,1-2H3,(H,11,12,13)
InChIKeyROCCVOGJWLBQOP-UHFFFAOYSA-N
XLogP0.68
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-hydroxy-N-(3-methyl-2-pyridinyl)propanamide
CID 130662699
(2S)-2-amino-N-(3-hydroxy-2-pyridinyl)propanamide
CID 103630280
(2R)-2-amino-N-(3-methyl-2-pyridinyl)pentanamide
CID 107568105
N,N'-bis(3-methyl-2-pyridinyl)-2-phenylpropanediamide
CID 3398462
(2S)-2-amino-N-(3-methyl-2-pyridinyl)-4-methylsulfanylbutanamide
CID 61148284
(2R)-N-(3-methyl-2-pyridinyl)-2-phenylsulfanylpropanamide
CID 39951954
2-[(4-amino-1,3,5-triazin-2-yl)sulfanyl]-N-(3-methyl-2-pyridinyl)propanamide
CID 71669882
1-methyl-3-(3-methyl-2-pyridinyl)urea
CID 17171367
2-amino-N-[(3-methyl-2-pyridinyl)methyl]propanamide
CID 63306534
2,2-dimethyl-N-(3-methyl-2-pyridinyl)propanamide
CID 1479965
N-(3-methyl-2-pyridinyl)prop-2-enamide
CID 43616345
2-(2,4-dichlorophenoxy)-N-(3-methyl-2-pyridinyl)propanamide
CID 4097411

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-methyl-2-pyridinyl)propanamide?
The IUPAC name of 2-amino-N-(3-methyl-2-pyridinyl)propanamide (CID 60731979) is 2-amino-N-(3-methyl-2-pyridinyl)propanamide.
What is the SMILES notation for 2-amino-N-(3-methyl-2-pyridinyl)propanamide?
The canonical SMILES for 2-amino-N-(3-methyl-2-pyridinyl)propanamide is Cc1cccnc1NC(=O)C(C)N.
What is the InChIKey of 2-amino-N-(3-methyl-2-pyridinyl)propanamide?
The InChIKey is ROCCVOGJWLBQOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c1-6-4-3-5-11-8(6)12-9(13)7(2)10/h3-5,7H,10H2,1-2H3,(H,11,12,13).
What are the key properties of 2-amino-N-(3-methyl-2-pyridinyl)propanamide?
2-amino-N-(3-methyl-2-pyridinyl)propanamide has a molecular weight of 179.22 g/mol, XLogP of 0.68, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-methyl-2-pyridinyl)propanamide is sourced from PubChem (CID 60731979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).