2,2-dimethyl-N-(1,7-naphthyridin-8-ylcarbamoyl)propanamide

C14H16N4O2 — CID 3684737

IUPAC2,2-dimethyl-N-(1,7-naphthyridin-8-ylcarbamoyl)propanamide
SMILESCC(C)(C)C(=O)NC(=O)Nc1nccc2cccnc12
InChIInChI=1S/C14H16N4O2/c1-14(2,3)12(19)18-13(20)17-11-10-9(6-8-16-11)5-4-7-15-10/h4-8H,1-3H3,(H2,16,17,18,19,20)
InChIKeyIKNHJLHWJWCSQM-UHFFFAOYSA-N
MW272.31 g/mol
LogP2.32
Rot. Bonds1

About 2,2-dimethyl-N-(1,7-naphthyridin-8-ylcarbamoyl)propanamide

2,2-dimethyl-N-(1,7-naphthyridin-8-ylcarbamoyl)propanamide (PubChem CID 3684737) has the molecular formula C14H16N4O2 and a molecular weight of 272.31 g/mol. Its IUPAC name is 2,2-dimethyl-N-(1,7-naphthyridin-8-ylcarbamoyl)propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-(1,7-naphthyridin-8-ylcarbamoyl)propanamide
PubChem CID3684737
Molecular FormulaC14H16N4O2
Molecular Weight272.31 g/mol
Exact Mass272.13
IUPAC Name2,2-dimethyl-N-(1,7-naphthyridin-8-ylcarbamoyl)propanamide
SMILESCC(C)(C)C(=O)NC(=O)Nc1nccc2cccnc12
InChIInChI=1S/C14H16N4O2/c1-14(2,3)12(19)18-13(20)17-11-10-9(6-8-16-11)5-4-7-15-10/h4-8H,1-3H3,(H2,16,17,18,19,20)
InChIKeyIKNHJLHWJWCSQM-UHFFFAOYSA-N
XLogP2.32
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,2-dimethyl-N-quinolin-8-ylpropanamide;molecular hydrogen
CID 143593011
N-isoquinolin-1-yl-2,2-dimethylpropanamide
CID 598735
2,2-dimethyl-N-(3-trimethylsilyl-2-pyridinyl)propanamide
CID 15914609
2,2-dimethyl-N-(3-methyl-2-pyridinyl)propanamide
CID 1479965
2,2-dimethyl-N-[(3-methyl-2-pyridinyl)carbamothioyl]propanamide
CID 17099829
2,2-dimethyl-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]propanamide
CID 17424107
1-(3-methyl-2-pyridinyl)-3-(trifluoromethyl)urea
CID 108866068
CID 89491536
CID 89491536
N-(2,2-dimethylpropyl)-2-[(3-methoxy-2-pyridinyl)carbamoylamino]-2-methylpropanamide
CID 119052985
2,2-dimethyl-N-[(1R)-2,2,2-trichloro-1-(quinolin-8-ylamino)ethyl]propanamide
CID 1132301
6-cyclobutyl-4-methyl-N-(1,7-naphthyridin-8-yl)-2-oxopyran-3-carboxamide
CID 170503536
2,2-dimethyl-N-[3-(methylsulfanylmethyl)-2-pyridinyl]propanamide
CID 13154241

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(1,7-naphthyridin-8-ylcarbamoyl)propanamide?
The IUPAC name of 2,2-dimethyl-N-(1,7-naphthyridin-8-ylcarbamoyl)propanamide (CID 3684737) is 2,2-dimethyl-N-(1,7-naphthyridin-8-ylcarbamoyl)propanamide.
What is the SMILES notation for 2,2-dimethyl-N-(1,7-naphthyridin-8-ylcarbamoyl)propanamide?
The canonical SMILES for 2,2-dimethyl-N-(1,7-naphthyridin-8-ylcarbamoyl)propanamide is CC(C)(C)C(=O)NC(=O)Nc1nccc2cccnc12.
What is the InChIKey of 2,2-dimethyl-N-(1,7-naphthyridin-8-ylcarbamoyl)propanamide?
The InChIKey is IKNHJLHWJWCSQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O2/c1-14(2,3)12(19)18-13(20)17-11-10-9(6-8-16-11)5-4-7-15-10/h4-8H,1-3H3,(H2,16,17,18,19,20).
What are the key properties of 2,2-dimethyl-N-(1,7-naphthyridin-8-ylcarbamoyl)propanamide?
2,2-dimethyl-N-(1,7-naphthyridin-8-ylcarbamoyl)propanamide has a molecular weight of 272.31 g/mol, XLogP of 2.32, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(1,7-naphthyridin-8-ylcarbamoyl)propanamide is sourced from PubChem (CID 3684737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).