N-(6-methoxy-3-methyl-1H-indol-7-yl)formamide

C11H12N2O2 — CID 145326207

IUPACN-(6-methoxy-3-methyl-1H-indol-7-yl)formamide
SMILESCOc1ccc2c(C)c[nH]c2c1NC=O
InChIInChI=1S/C11H12N2O2/c1-7-5-12-10-8(7)3-4-9(15-2)11(10)13-6-14/h3-6,12H,1-2H3,(H,13,14)
InChIKeyMKEQDMHBDLHSIC-UHFFFAOYSA-N
MW204.23 g/mol
LogP2.05
Rot. Bonds3

About N-(6-methoxy-3-methyl-1H-indol-7-yl)formamide

N-(6-methoxy-3-methyl-1H-indol-7-yl)formamide (PubChem CID 145326207) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is N-(6-methoxy-3-methyl-1H-indol-7-yl)formamide.

Molecular Properties

Compound NameN-(6-methoxy-3-methyl-1H-indol-7-yl)formamide
PubChem CID145326207
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC NameN-(6-methoxy-3-methyl-1H-indol-7-yl)formamide
SMILESCOc1ccc2c(C)c[nH]c2c1NC=O
InChIInChI=1S/C11H12N2O2/c1-7-5-12-10-8(7)3-4-9(15-2)11(10)13-6-14/h3-6,12H,1-2H3,(H,13,14)
InChIKeyMKEQDMHBDLHSIC-UHFFFAOYSA-N
XLogP2.05
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-(8-methoxy-2-methylquinolin-5-yl)formamide
CID 168651038
N-(2-cyano-6-methoxyphenyl)formamide
CID 107468180
7-methoxy-3-methyl-1H-indol-5-ol
CID 84655900
3-bromo-6-methoxy-7-methyl-1H-indole
CID 130052152
N-(4-formyl-2,6-dimethoxyphenyl)formamide
CID 21281019
3-(2,3-dimethoxy-6-methylphenyl)propanal
CID 117297640
N-(3-fluoro-2,4-dimethoxyphenyl)formamide
CID 168651681
6,7-dimethoxy-4-methyl-2H-isoquinolin-1-one
CID 167049433
(E)-3-(7-methoxy-3-methyl-1H-indol-5-yl)prop-2-en-1-amine
CID 117308381
N-(3-methoxy-2,4-dimethylphenyl)formamide
CID 64992554
5-methoxy-3,7-dimethyl-1H-indole
CID 82490544
3-isocyanato-7-methoxy-4-methyl-1H-indole
CID 84619822

Frequently Asked Questions

What is the IUPAC name of N-(6-methoxy-3-methyl-1H-indol-7-yl)formamide?
The IUPAC name of N-(6-methoxy-3-methyl-1H-indol-7-yl)formamide (CID 145326207) is N-(6-methoxy-3-methyl-1H-indol-7-yl)formamide.
What is the SMILES notation for N-(6-methoxy-3-methyl-1H-indol-7-yl)formamide?
The canonical SMILES for N-(6-methoxy-3-methyl-1H-indol-7-yl)formamide is COc1ccc2c(C)c[nH]c2c1NC=O.
What is the InChIKey of N-(6-methoxy-3-methyl-1H-indol-7-yl)formamide?
The InChIKey is MKEQDMHBDLHSIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-7-5-12-10-8(7)3-4-9(15-2)11(10)13-6-14/h3-6,12H,1-2H3,(H,13,14).
What are the key properties of N-(6-methoxy-3-methyl-1H-indol-7-yl)formamide?
N-(6-methoxy-3-methyl-1H-indol-7-yl)formamide has a molecular weight of 204.23 g/mol, XLogP of 2.05, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxy-3-methyl-1H-indol-7-yl)formamide is sourced from PubChem (CID 145326207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).