7-amino-2-[4-(1,5-dimethylimidazol-2-yl)-2-fluorophenyl]-N-methyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide

C20H19FN6O — CID 146634932

IUPAC7-amino-2-[4-(1,5-dimethylimidazol-2-yl)-2-fluorophenyl]-N-methyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide
SMILESCNC(=O)c1cnc(N)c2[nH]c(-c3ccc(-c4ncc(C)n4C)cc3F)cc12
InChIInChI=1S/C20H19FN6O/c1-10-8-25-19(27(10)3)11-4-5-12(15(21)6-11)16-7-13-14(20(28)23-2)9-24-18(22)17(13)26-16/h4-9,26H,1-3H3,(H2,22,24)(H,23,28)
InChIKeyYNJRBFLTTXANJG-UHFFFAOYSA-N
MW378.41 g/mol
LogP3.02
Rot. Bonds3

About 7-amino-2-[4-(1,5-dimethylimidazol-2-yl)-2-fluorophenyl]-N-methyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide

7-amino-2-[4-(1,5-dimethylimidazol-2-yl)-2-fluorophenyl]-N-methyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide (PubChem CID 146634932) has the molecular formula C20H19FN6O and a molecular weight of 378.41 g/mol. Its IUPAC name is 7-amino-2-[4-(1,5-dimethylimidazol-2-yl)-2-fluorophenyl]-N-methyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide.

Molecular Properties

Compound Name7-amino-2-[4-(1,5-dimethylimidazol-2-yl)-2-fluorophenyl]-N-methyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide
PubChem CID146634932
Molecular FormulaC20H19FN6O
Molecular Weight378.41 g/mol
Exact Mass378.16
IUPAC Name7-amino-2-[4-(1,5-dimethylimidazol-2-yl)-2-fluorophenyl]-N-methyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide
SMILESCNC(=O)c1cnc(N)c2[nH]c(-c3ccc(-c4ncc(C)n4C)cc3F)cc12
InChIInChI=1S/C20H19FN6O/c1-10-8-25-19(27(10)3)11-4-5-12(15(21)6-11)16-7-13-14(20(28)23-2)9-24-18(22)17(13)26-16/h4-9,26H,1-3H3,(H2,22,24)(H,23,28)
InChIKeyYNJRBFLTTXANJG-UHFFFAOYSA-N
XLogP3.02
TPSA101.62 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.41
LogP ≤ 53.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

7-(dibenzylamino)-2-[2-fluoro-4-(1,4,5-trimethylimidazol-2-yl)phenyl]-N-methyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide
CID 146634521
7-amino-2-[2-fluoro-3-(oxolan-2-yl)phenyl]-N-methyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide
CID 146634949
7-amino-2-[2-fluoro-6-[(3R)-3-methoxypyrrolidin-1-yl]-4-(1-methylimidazol-2-yl)phenyl]-N-methyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide
CID 156567007
methyl 7-amino-2-[2-ethoxy-5-(1-methylpyrazol-3-yl)-3-pyridinyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate
CID 146634369
4-amino-2-(4-fluorophenyl)-N-methylpyrimidine-5-carboxamide
CID 83567202
methyl 7-amino-2-[3-(1-methyl-1,2,4-triazol-3-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate
CID 146634456
7-(cyclopropanecarbonylamino)-2-[2-fluoro-3-(3-methyl-1,2,4-triazol-1-yl)phenyl]-N-methyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide
CID 146592237
methyl 7-amino-2-(2-cyclopropylindazol-6-yl)-1H-pyrrolo[2,3-c]pyridine-4-carboxylate
CID 153498799
7-(cyclopropanecarbonylamino)-2-[5-(dimethylcarbamoyl)-3-fluoro-2-pyridinyl]-N-methyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide
CID 146592225
N,1,6-trimethyl-2-oxopyridine-3-carboxamide
CID 131179511
7-(cyclopropanecarbonylamino)-N-methyl-2-[2-(4-oxopiperidin-1-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxamide
CID 146634379
4-amino-N,6-dimethylpyridine-3-carboxamide
CID 81236701

Frequently Asked Questions

What is the IUPAC name of 7-amino-2-[4-(1,5-dimethylimidazol-2-yl)-2-fluorophenyl]-N-methyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide?
The IUPAC name of 7-amino-2-[4-(1,5-dimethylimidazol-2-yl)-2-fluorophenyl]-N-methyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide (CID 146634932) is 7-amino-2-[4-(1,5-dimethylimidazol-2-yl)-2-fluorophenyl]-N-methyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide.
What is the SMILES notation for 7-amino-2-[4-(1,5-dimethylimidazol-2-yl)-2-fluorophenyl]-N-methyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide?
The canonical SMILES for 7-amino-2-[4-(1,5-dimethylimidazol-2-yl)-2-fluorophenyl]-N-methyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide is CNC(=O)c1cnc(N)c2[nH]c(-c3ccc(-c4ncc(C)n4C)cc3F)cc12.
What is the InChIKey of 7-amino-2-[4-(1,5-dimethylimidazol-2-yl)-2-fluorophenyl]-N-methyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide?
The InChIKey is YNJRBFLTTXANJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN6O/c1-10-8-25-19(27(10)3)11-4-5-12(15(21)6-11)16-7-13-14(20(28)23-2)9-24-18(22)17(13)26-16/h4-9,26H,1-3H3,(H2,22,24)(H,23,28).
What are the key properties of 7-amino-2-[4-(1,5-dimethylimidazol-2-yl)-2-fluorophenyl]-N-methyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide?
7-amino-2-[4-(1,5-dimethylimidazol-2-yl)-2-fluorophenyl]-N-methyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide has a molecular weight of 378.41 g/mol, XLogP of 3.02, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-2-[4-(1,5-dimethylimidazol-2-yl)-2-fluorophenyl]-N-methyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide is sourced from PubChem (CID 146634932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).