N-(7-amino-1,8-naphthyridin-2-yl)-2-methylpropanamide

C12H14N4O — CID 46866816

IUPACN-(7-amino-1,8-naphthyridin-2-yl)-2-methylpropanamide
SMILESCC(C)C(=O)Nc1ccc2ccc(N)nc2n1
InChIInChI=1S/C12H14N4O/c1-7(2)12(17)16-10-6-4-8-3-5-9(13)14-11(8)15-10/h3-7H,1-2H3,(H3,13,14,15,16,17)
InChIKeyVQWJKHOJZWMTOS-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.81
Rot. Bonds2

About N-(7-amino-1,8-naphthyridin-2-yl)-2-methylpropanamide

N-(7-amino-1,8-naphthyridin-2-yl)-2-methylpropanamide (PubChem CID 46866816) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is N-(7-amino-1,8-naphthyridin-2-yl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(7-amino-1,8-naphthyridin-2-yl)-2-methylpropanamide
PubChem CID46866816
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC NameN-(7-amino-1,8-naphthyridin-2-yl)-2-methylpropanamide
SMILESCC(C)C(=O)Nc1ccc2ccc(N)nc2n1
InChIInChI=1S/C12H14N4O/c1-7(2)12(17)16-10-6-4-8-3-5-9(13)14-11(8)15-10/h3-7H,1-2H3,(H3,13,14,15,16,17)
InChIKeyVQWJKHOJZWMTOS-UHFFFAOYSA-N
XLogP1.81
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6-amino-2-pyridinyl)-2,3-dimethylbutanamide
CID 121221980
heptane;7-methyl-1,8-naphthyridin-2-amine;N-(7-methyl-1,8-naphthyridin-2-yl)-3-[[3-[(7-methyl-1,8-naphthyridin-2-yl)amino]-3-oxopropyl]amino]propanamide
CID 158365975
N-(6-fluoro-2-pyridinyl)-2-methylpropanamide
CID 104820526
N-(7-amino-1,8-naphthyridin-2-yl)-2-methyl-4-[(E)-3,3,3-trifluoroprop-1-enyl]benzamide
CID 143533156
N-(5-bromo-2-pyridinyl)-2-methylpropanamide
CID 14988412
N-(7-chloro-1,8-naphthyridin-2-yl)butanamide
CID 102404571
N-(5-amino-1-methylpyrazol-3-yl)-2-methylpropanamide
CID 162759817
N-[6-amino-5-(2-chloro-5-methoxyphenyl)-2-pyridinyl]-2-methylpropanamide
CID 122181200
N-(5-amino-4-methyl-2-pyridinyl)-2-methylpropanamide
CID 18525004
N-[5-(hydroxymethyl)-2-pyridinyl]-2-methylpropanamide
CID 82343659
N-[6-[(tert-butylamino)methyl]-5-hydroxy-2-pyridinyl]-2-methylpropanamide;methane
CID 19831996
2-methyl-N-pyridazin-3-ylpropanamide
CID 126995895

Frequently Asked Questions

What is the IUPAC name of N-(7-amino-1,8-naphthyridin-2-yl)-2-methylpropanamide?
The IUPAC name of N-(7-amino-1,8-naphthyridin-2-yl)-2-methylpropanamide (CID 46866816) is N-(7-amino-1,8-naphthyridin-2-yl)-2-methylpropanamide.
What is the SMILES notation for N-(7-amino-1,8-naphthyridin-2-yl)-2-methylpropanamide?
The canonical SMILES for N-(7-amino-1,8-naphthyridin-2-yl)-2-methylpropanamide is CC(C)C(=O)Nc1ccc2ccc(N)nc2n1.
What is the InChIKey of N-(7-amino-1,8-naphthyridin-2-yl)-2-methylpropanamide?
The InChIKey is VQWJKHOJZWMTOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c1-7(2)12(17)16-10-6-4-8-3-5-9(13)14-11(8)15-10/h3-7H,1-2H3,(H3,13,14,15,16,17).
What are the key properties of N-(7-amino-1,8-naphthyridin-2-yl)-2-methylpropanamide?
N-(7-amino-1,8-naphthyridin-2-yl)-2-methylpropanamide has a molecular weight of 230.27 g/mol, XLogP of 1.81, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-amino-1,8-naphthyridin-2-yl)-2-methylpropanamide is sourced from PubChem (CID 46866816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).