N-[2-(5-fluoro-2-pyridinyl)-1H-pyrrolo[3,2-c]pyridin-6-yl]cyclopropanecarboxamide

C16H13FN4O — CID 169097714

IUPACN-[2-(5-fluoro-2-pyridinyl)-1H-pyrrolo[3,2-c]pyridin-6-yl]cyclopropanecarboxamide
SMILESO=C(Nc1cc2[nH]c(-c3ccc(F)cn3)cc2cn1)C1CC1
InChIInChI=1S/C16H13FN4O/c17-11-3-4-12(18-8-11)14-5-10-7-19-15(6-13(10)20-14)21-16(22)9-1-2-9/h3-9,20H,1-2H2,(H,19,21,22)
InChIKeyKMBRNAJDEPINIS-UHFFFAOYSA-N
MW296.31 g/mol
LogP3.11
Rot. Bonds3

About N-[2-(5-fluoro-2-pyridinyl)-1H-pyrrolo[3,2-c]pyridin-6-yl]cyclopropanecarboxamide

N-[2-(5-fluoro-2-pyridinyl)-1H-pyrrolo[3,2-c]pyridin-6-yl]cyclopropanecarboxamide (PubChem CID 169097714) has the molecular formula C16H13FN4O and a molecular weight of 296.31 g/mol. Its IUPAC name is N-[2-(5-fluoro-2-pyridinyl)-1H-pyrrolo[3,2-c]pyridin-6-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[2-(5-fluoro-2-pyridinyl)-1H-pyrrolo[3,2-c]pyridin-6-yl]cyclopropanecarboxamide
PubChem CID169097714
Molecular FormulaC16H13FN4O
Molecular Weight296.31 g/mol
Exact Mass296.11
IUPAC NameN-[2-(5-fluoro-2-pyridinyl)-1H-pyrrolo[3,2-c]pyridin-6-yl]cyclopropanecarboxamide
SMILESO=C(Nc1cc2[nH]c(-c3ccc(F)cn3)cc2cn1)C1CC1
InChIInChI=1S/C16H13FN4O/c17-11-3-4-12(18-8-11)14-5-10-7-19-15(6-13(10)20-14)21-16(22)9-1-2-9/h3-9,20H,1-2H2,(H,19,21,22)
InChIKeyKMBRNAJDEPINIS-UHFFFAOYSA-N
XLogP3.11
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.31
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2,6-difluoro-4-pyridinyl)-1H-pyrrolo[3,2-c]pyridin-6-yl]cyclopropanecarboxamide
CID 169097673
iron;N-[2-(2-methanidylpyrimidin-4-yl)-1H-pyrrolo[3,2-c]pyridin-6-yl]cyclopropanecarboxamide
CID 171432742
3-hydroxy-N-[2-[2-(trifluoromethyl)pyrimidin-4-yl]-1H-pyrrolo[3,2-c]pyridin-6-yl]cyclobutane-1-carboxamide
CID 164564792
N-(2-pyridin-3-yl-1H-pyrrolo[3,2-c]pyridin-6-yl)cyclopentanecarboxamide
CID 164564726
N-[2-(2-methyl-4-pyridinyl)-1H-pyrrolo[3,2-c]pyridin-6-yl]oxane-3-carboxamide
CID 164564847
N-[2-(2-methyl-4-pyridinyl)-1H-pyrrolo[3,2-c]pyridin-6-yl]bicyclo[3.1.0]hexane-6-carboxamide
CID 169097630
N-[7-(5-fluoro-2-methylphenyl)-5-methylsulfinyl-2,6-naphthyridin-3-yl]cyclopropanecarboxamide
CID 129170091
N-(7-hydroxyisoquinolin-3-yl)cyclopropanecarboxamide
CID 67975011
N-[7-(2-cyano-5-fluoro-3-pyridinyl)isoquinolin-3-yl]cyclopropanecarboxamide
CID 57410357
1-acetyl-N-(5-fluoro-2-pyridinyl)piperidine-4-carboxamide
CID 163343949
N-[5-acetyl-4-[3-(5-fluoro-2-pyridinyl)-2-methoxyanilino]-2-pyridinyl]cyclopropanecarboxamide
CID 166492549
N-[6-(3-fluoroanilino)-3-pyridinyl]cyclopropanecarboxamide
CID 113021257

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-fluoro-2-pyridinyl)-1H-pyrrolo[3,2-c]pyridin-6-yl]cyclopropanecarboxamide?
The IUPAC name of N-[2-(5-fluoro-2-pyridinyl)-1H-pyrrolo[3,2-c]pyridin-6-yl]cyclopropanecarboxamide (CID 169097714) is N-[2-(5-fluoro-2-pyridinyl)-1H-pyrrolo[3,2-c]pyridin-6-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[2-(5-fluoro-2-pyridinyl)-1H-pyrrolo[3,2-c]pyridin-6-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[2-(5-fluoro-2-pyridinyl)-1H-pyrrolo[3,2-c]pyridin-6-yl]cyclopropanecarboxamide is O=C(Nc1cc2[nH]c(-c3ccc(F)cn3)cc2cn1)C1CC1.
What is the InChIKey of N-[2-(5-fluoro-2-pyridinyl)-1H-pyrrolo[3,2-c]pyridin-6-yl]cyclopropanecarboxamide?
The InChIKey is KMBRNAJDEPINIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN4O/c17-11-3-4-12(18-8-11)14-5-10-7-19-15(6-13(10)20-14)21-16(22)9-1-2-9/h3-9,20H,1-2H2,(H,19,21,22).
What are the key properties of N-[2-(5-fluoro-2-pyridinyl)-1H-pyrrolo[3,2-c]pyridin-6-yl]cyclopropanecarboxamide?
N-[2-(5-fluoro-2-pyridinyl)-1H-pyrrolo[3,2-c]pyridin-6-yl]cyclopropanecarboxamide has a molecular weight of 296.31 g/mol, XLogP of 3.11, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-fluoro-2-pyridinyl)-1H-pyrrolo[3,2-c]pyridin-6-yl]cyclopropanecarboxamide is sourced from PubChem (CID 169097714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).