3-(6-methoxy-1-methylindazol-3-yl)-N,N-dimethylpropanamide

C14H19N3O2 — CID 70659969

IUPAC3-(6-methoxy-1-methylindazol-3-yl)-N,N-dimethylpropanamide
SMILESCOc1ccc2c(CCC(=O)N(C)C)nn(C)c2c1
InChIInChI=1S/C14H19N3O2/c1-16(2)14(18)8-7-12-11-6-5-10(19-4)9-13(11)17(3)15-12/h5-6,9H,7-8H2,1-4H3
InChIKeyGYELQZYWFUPXSJ-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.60
Rot. Bonds4

About 3-(6-methoxy-1-methylindazol-3-yl)-N,N-dimethylpropanamide

3-(6-methoxy-1-methylindazol-3-yl)-N,N-dimethylpropanamide (PubChem CID 70659969) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 3-(6-methoxy-1-methylindazol-3-yl)-N,N-dimethylpropanamide.

Molecular Properties

Compound Name3-(6-methoxy-1-methylindazol-3-yl)-N,N-dimethylpropanamide
PubChem CID70659969
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name3-(6-methoxy-1-methylindazol-3-yl)-N,N-dimethylpropanamide
SMILESCOc1ccc2c(CCC(=O)N(C)C)nn(C)c2c1
InChIInChI=1S/C14H19N3O2/c1-16(2)14(18)8-7-12-11-6-5-10(19-4)9-13(11)17(3)15-12/h5-6,9H,7-8H2,1-4H3
InChIKeyGYELQZYWFUPXSJ-UHFFFAOYSA-N
XLogP1.60
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-iodo-5-methoxyphenyl)-N,N-dimethylpropanamide
CID 14025499
5-methoxy-1-methylindazole-3-carboxylic acid
CID 45141403
2-(2-chloro-6-methoxybenzimidazol-1-yl)-N,N-dimethylacetamide
CID 155143022
3-[[(1S)-1-(2-bromo-4-methoxyphenyl)ethyl]amino]-N,N-dimethylpropanamide
CID 97336153
7-methoxy-1-methylcinnolin-4-one
CID 89165041
methyl 3-(6-methoxy-1-methylindol-3-yl)propanoate
CID 71520642
3-[5-(4-methoxyphenyl)-1H-pyrrol-3-yl]-N,N-dimethylpropanamide
CID 68636010
3-[2-(hydroxymethyl)-5-methoxyphenoxy]-N,N-dimethylpropanamide
CID 61269047
3-[2-(hydroxymethyl)-4-methoxyphenoxy]-N,N-dimethylpropanamide
CID 54879094
3-[2-(aminomethyl)-5-methoxyphenoxy]-N,N-dimethylpropanamide
CID 61269630
2-(2-amino-4-methoxyphenoxy)-N,N-dimethylacetamide
CID 16771171
4-[2-[(1R)-1-aminoethyl]-5-methoxyphenoxy]-N,N-dimethylbutanamide
CID 82001215

Frequently Asked Questions

What is the IUPAC name of 3-(6-methoxy-1-methylindazol-3-yl)-N,N-dimethylpropanamide?
The IUPAC name of 3-(6-methoxy-1-methylindazol-3-yl)-N,N-dimethylpropanamide (CID 70659969) is 3-(6-methoxy-1-methylindazol-3-yl)-N,N-dimethylpropanamide.
What is the SMILES notation for 3-(6-methoxy-1-methylindazol-3-yl)-N,N-dimethylpropanamide?
The canonical SMILES for 3-(6-methoxy-1-methylindazol-3-yl)-N,N-dimethylpropanamide is COc1ccc2c(CCC(=O)N(C)C)nn(C)c2c1.
What is the InChIKey of 3-(6-methoxy-1-methylindazol-3-yl)-N,N-dimethylpropanamide?
The InChIKey is GYELQZYWFUPXSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-16(2)14(18)8-7-12-11-6-5-10(19-4)9-13(11)17(3)15-12/h5-6,9H,7-8H2,1-4H3.
What are the key properties of 3-(6-methoxy-1-methylindazol-3-yl)-N,N-dimethylpropanamide?
3-(6-methoxy-1-methylindazol-3-yl)-N,N-dimethylpropanamide has a molecular weight of 261.32 g/mol, XLogP of 1.60, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-methoxy-1-methylindazol-3-yl)-N,N-dimethylpropanamide is sourced from PubChem (CID 70659969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).