2,2,3,3-tetramethyl-N-[3-(1-methyltriazol-4-yl)-1,7-naphthyridin-6-yl]cyclopropane-1-carboxamide

C19H22N6O — CID 138590781

IUPAC2,2,3,3-tetramethyl-N-[3-(1-methyltriazol-4-yl)-1,7-naphthyridin-6-yl]cyclopropane-1-carboxamide
SMILESCn1cc(-c2cnc3cnc(NC(=O)C4C(C)(C)C4(C)C)cc3c2)nn1
InChIInChI=1S/C19H22N6O/c1-18(2)16(19(18,3)4)17(26)22-15-7-11-6-12(8-20-13(11)9-21-15)14-10-25(5)24-23-14/h6-10,16H,1-5H3,(H,21,22,26)
InChIKeyZKOXJDDUYFUCJM-UHFFFAOYSA-N
MW350.43 g/mol
LogP3.05
Rot. Bonds3

About 2,2,3,3-tetramethyl-N-[3-(1-methyltriazol-4-yl)-1,7-naphthyridin-6-yl]cyclopropane-1-carboxamide

2,2,3,3-tetramethyl-N-[3-(1-methyltriazol-4-yl)-1,7-naphthyridin-6-yl]cyclopropane-1-carboxamide (PubChem CID 138590781) has the molecular formula C19H22N6O and a molecular weight of 350.43 g/mol. Its IUPAC name is 2,2,3,3-tetramethyl-N-[3-(1-methyltriazol-4-yl)-1,7-naphthyridin-6-yl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2,2,3,3-tetramethyl-N-[3-(1-methyltriazol-4-yl)-1,7-naphthyridin-6-yl]cyclopropane-1-carboxamide
PubChem CID138590781
Molecular FormulaC19H22N6O
Molecular Weight350.43 g/mol
Exact Mass350.19
IUPAC Name2,2,3,3-tetramethyl-N-[3-(1-methyltriazol-4-yl)-1,7-naphthyridin-6-yl]cyclopropane-1-carboxamide
SMILESCn1cc(-c2cnc3cnc(NC(=O)C4C(C)(C)C4(C)C)cc3c2)nn1
InChIInChI=1S/C19H22N6O/c1-18(2)16(19(18,3)4)17(26)22-15-7-11-6-12(8-20-13(11)9-21-15)14-10-25(5)24-23-14/h6-10,16H,1-5H3,(H,21,22,26)
InChIKeyZKOXJDDUYFUCJM-UHFFFAOYSA-N
XLogP3.05
TPSA85.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.43
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[3-(1-methyltriazol-4-yl)-1,7-naphthyridin-6-yl]-1-(1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide
CID 138586828
1-cyclopropyl-2-[3-(1-methyltriazol-4-yl)-1,7-naphthyridin-6-yl]ethanone
CID 146828434
2-(4-methyl-1,4-diazepan-1-yl)-N-[3-(1-methyltriazol-4-yl)-1,7-naphthyridin-6-yl]pyridine-4-carboxamide
CID 138586731
4-[[3-(1-methylpyrazol-4-yl)-1,7-naphthyridin-6-yl]carbamoyl]cyclohexane-1-carboxylic acid
CID 138588832
2-fluoro-2-methyl-N-[6-(1-methyltriazol-4-yl)cinnolin-3-yl]propanamide
CID 138589575
1-(2-fluoroethyl)-N-[3-(1-methylpyrazol-4-yl)-1,7-naphthyridin-6-yl]piperidine-4-carboxamide
CID 138587793
4,4-difluoro-N-[2-(1-methyltriazol-4-yl)-1,6-naphthyridin-7-yl]cyclohexane-1-carboxamide
CID 138588625
N-[3-(2,3-dimethylimidazol-4-yl)-1,7-naphthyridin-6-yl]cyclohexanecarboxamide
CID 138588999
4-(2-methoxyethylamino)-N-[3-(1-methylpyrazol-4-yl)-1,7-naphthyridin-6-yl]cyclohexane-1-carboxamide
CID 138591450
N-[6-(1-methyltriazol-4-yl)cinnolin-3-yl]piperidine-3-carboxamide
CID 138586977
N-[6-(1-methyltriazol-4-yl)isoquinolin-3-yl]morpholine-4-carboxamide
CID 138559189
1-methyl-N-[3-[6-(propan-2-ylamino)pyrazin-2-yl]-1,7-naphthyridin-6-yl]piperidine-4-carboxamide
CID 138590247

Frequently Asked Questions

What is the IUPAC name of 2,2,3,3-tetramethyl-N-[3-(1-methyltriazol-4-yl)-1,7-naphthyridin-6-yl]cyclopropane-1-carboxamide?
The IUPAC name of 2,2,3,3-tetramethyl-N-[3-(1-methyltriazol-4-yl)-1,7-naphthyridin-6-yl]cyclopropane-1-carboxamide (CID 138590781) is 2,2,3,3-tetramethyl-N-[3-(1-methyltriazol-4-yl)-1,7-naphthyridin-6-yl]cyclopropane-1-carboxamide.
What is the SMILES notation for 2,2,3,3-tetramethyl-N-[3-(1-methyltriazol-4-yl)-1,7-naphthyridin-6-yl]cyclopropane-1-carboxamide?
The canonical SMILES for 2,2,3,3-tetramethyl-N-[3-(1-methyltriazol-4-yl)-1,7-naphthyridin-6-yl]cyclopropane-1-carboxamide is Cn1cc(-c2cnc3cnc(NC(=O)C4C(C)(C)C4(C)C)cc3c2)nn1.
What is the InChIKey of 2,2,3,3-tetramethyl-N-[3-(1-methyltriazol-4-yl)-1,7-naphthyridin-6-yl]cyclopropane-1-carboxamide?
The InChIKey is ZKOXJDDUYFUCJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O/c1-18(2)16(19(18,3)4)17(26)22-15-7-11-6-12(8-20-13(11)9-21-15)14-10-25(5)24-23-14/h6-10,16H,1-5H3,(H,21,22,26).
What are the key properties of 2,2,3,3-tetramethyl-N-[3-(1-methyltriazol-4-yl)-1,7-naphthyridin-6-yl]cyclopropane-1-carboxamide?
2,2,3,3-tetramethyl-N-[3-(1-methyltriazol-4-yl)-1,7-naphthyridin-6-yl]cyclopropane-1-carboxamide has a molecular weight of 350.43 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3-tetramethyl-N-[3-(1-methyltriazol-4-yl)-1,7-naphthyridin-6-yl]cyclopropane-1-carboxamide is sourced from PubChem (CID 138590781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).