1-methyl-N-(1-methylimidazol-2-yl)indole-4-carboxamide

C14H14N4O — CID 134712669

IUPAC1-methyl-N-(1-methylimidazol-2-yl)indole-4-carboxamide
SMILESCn1ccnc1NC(=O)c1cccc2c1ccn2C
InChIInChI=1S/C14H14N4O/c1-17-8-6-10-11(4-3-5-12(10)17)13(19)16-14-15-7-9-18(14)2/h3-9H,1-2H3,(H,15,16,19)
InChIKeySFRSMWYYEBRHIP-UHFFFAOYSA-N
MW254.29 g/mol
LogP2.16
Rot. Bonds2

About 1-methyl-N-(1-methylimidazol-2-yl)indole-4-carboxamide

1-methyl-N-(1-methylimidazol-2-yl)indole-4-carboxamide (PubChem CID 134712669) has the molecular formula C14H14N4O and a molecular weight of 254.29 g/mol. Its IUPAC name is 1-methyl-N-(1-methylimidazol-2-yl)indole-4-carboxamide.

Molecular Properties

Compound Name1-methyl-N-(1-methylimidazol-2-yl)indole-4-carboxamide
PubChem CID134712669
Molecular FormulaC14H14N4O
Molecular Weight254.29 g/mol
Exact Mass254.12
IUPAC Name1-methyl-N-(1-methylimidazol-2-yl)indole-4-carboxamide
SMILESCn1ccnc1NC(=O)c1cccc2c1ccn2C
InChIInChI=1S/C14H14N4O/c1-17-8-6-10-11(4-3-5-12(10)17)13(19)16-14-15-7-9-18(14)2/h3-9H,1-2H3,(H,15,16,19)
InChIKeySFRSMWYYEBRHIP-UHFFFAOYSA-N
XLogP2.16
TPSA51.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,3-dichlorophenyl)-1-methylindole-4-carboxamide
CID 112524553
1-methyl-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)indole-4-carboxamide
CID 45494179
1-methyl-N-(4-phenoxyphenyl)indole-4-carboxamide
CID 112523940
N-(2-ethoxyphenyl)-1-methylindole-4-carboxamide
CID 112522704
N-(1H-indazol-3-yl)-1-methylindole-4-carboxamide
CID 112527943
1-methyl-N-(3-methylsulfanylphenyl)indole-4-carboxamide
CID 51053502
1-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]indole-4-carboxamide
CID 71704096
1-methyl-N-pyrrolidin-3-ylindole-4-carboxamide
CID 112530853
N-(5-chloro-2-methoxyphenyl)-1-methylindole-4-carboxamide
CID 112520804
N-[4-fluoro-3-(prop-2-enoylamino)phenyl]-1-methylindole-4-carboxamide
CID 166405453
ethyl 2-[(1-methylindole-4-carbonyl)amino]-1,3-thiazole-4-carboxylate
CID 71702427
N-(5-acetamido-2-methoxyphenyl)-1-methylindole-4-carboxamide
CID 51108315

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(1-methylimidazol-2-yl)indole-4-carboxamide?
The IUPAC name of 1-methyl-N-(1-methylimidazol-2-yl)indole-4-carboxamide (CID 134712669) is 1-methyl-N-(1-methylimidazol-2-yl)indole-4-carboxamide.
What is the SMILES notation for 1-methyl-N-(1-methylimidazol-2-yl)indole-4-carboxamide?
The canonical SMILES for 1-methyl-N-(1-methylimidazol-2-yl)indole-4-carboxamide is Cn1ccnc1NC(=O)c1cccc2c1ccn2C.
What is the InChIKey of 1-methyl-N-(1-methylimidazol-2-yl)indole-4-carboxamide?
The InChIKey is SFRSMWYYEBRHIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O/c1-17-8-6-10-11(4-3-5-12(10)17)13(19)16-14-15-7-9-18(14)2/h3-9H,1-2H3,(H,15,16,19).
What are the key properties of 1-methyl-N-(1-methylimidazol-2-yl)indole-4-carboxamide?
1-methyl-N-(1-methylimidazol-2-yl)indole-4-carboxamide has a molecular weight of 254.29 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(1-methylimidazol-2-yl)indole-4-carboxamide is sourced from PubChem (CID 134712669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).