2-fluoro-1-(1H-pyrrolo[2,3-c]pyridin-5-yl)cyclopropane-1-carboxamide

C11H10FN3O — CID 175717705

IUPAC2-fluoro-1-(1H-pyrrolo[2,3-c]pyridin-5-yl)cyclopropane-1-carboxamide
SMILESNC(=O)C1(c2cc3cc[nH]c3cn2)CC1F
InChIInChI=1S/C11H10FN3O/c12-8-4-11(8,10(13)16)9-3-6-1-2-14-7(6)5-15-9/h1-3,5,8,14H,4H2,(H2,13,16)
InChIKeyLXFFIEBIRMMPQC-UHFFFAOYSA-N
MW219.22 g/mol
LogP1.03
Rot. Bonds2

About 2-fluoro-1-(1H-pyrrolo[2,3-c]pyridin-5-yl)cyclopropane-1-carboxamide

2-fluoro-1-(1H-pyrrolo[2,3-c]pyridin-5-yl)cyclopropane-1-carboxamide (PubChem CID 175717705) has the molecular formula C11H10FN3O and a molecular weight of 219.22 g/mol. Its IUPAC name is 2-fluoro-1-(1H-pyrrolo[2,3-c]pyridin-5-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-fluoro-1-(1H-pyrrolo[2,3-c]pyridin-5-yl)cyclopropane-1-carboxamide
PubChem CID175717705
Molecular FormulaC11H10FN3O
Molecular Weight219.22 g/mol
Exact Mass219.08
IUPAC Name2-fluoro-1-(1H-pyrrolo[2,3-c]pyridin-5-yl)cyclopropane-1-carboxamide
SMILESNC(=O)C1(c2cc3cc[nH]c3cn2)CC1F
InChIInChI=1S/C11H10FN3O/c12-8-4-11(8,10(13)16)9-3-6-1-2-14-7(6)5-15-9/h1-3,5,8,14H,4H2,(H2,13,16)
InChIKeyLXFFIEBIRMMPQC-UHFFFAOYSA-N
XLogP1.03
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.22
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1H-pyrrolo[2,3-c]pyridin-5-yl)acetamide
CID 139490788
5-fluoro-1H-pyrrolo[2,3-c]pyridine
CID 53399661
1H-pyrrolo[2,3-c]pyridin-5-ylcarbamic acid
CID 137499260
1H-pyrrolo[2,3-c]pyridin-5-ylmethanamine
CID 15521900
1H-pyrrolo[2,3-c]pyridin-5-amine;dihydrochloride
CID 67382254
CID 143215043
CID 143215043
1H-pyrrolo[2,3-c]pyridine-5-carbaldehyde;hydrochloride
CID 87581993
2-phenyl-N-(1H-pyrrolo[2,3-c]pyridin-5-yl)acetamide
CID 168875352
5-(1,3-dioxolan-2-yl)-1H-pyrrolo[2,3-c]pyridine
CID 14644282
1-methyl-N-(1H-pyrrolo[2,3-c]pyridin-5-ylmethyl)piperidine-4-carboxamide
CID 167064572
N-(2,2-difluoroethyl)-1H-pyrrolo[2,3-c]pyridin-5-amine
CID 130637894
carbamic acid;1H-indole
CID 66672708

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-1-(1H-pyrrolo[2,3-c]pyridin-5-yl)cyclopropane-1-carboxamide?
The IUPAC name of 2-fluoro-1-(1H-pyrrolo[2,3-c]pyridin-5-yl)cyclopropane-1-carboxamide (CID 175717705) is 2-fluoro-1-(1H-pyrrolo[2,3-c]pyridin-5-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for 2-fluoro-1-(1H-pyrrolo[2,3-c]pyridin-5-yl)cyclopropane-1-carboxamide?
The canonical SMILES for 2-fluoro-1-(1H-pyrrolo[2,3-c]pyridin-5-yl)cyclopropane-1-carboxamide is NC(=O)C1(c2cc3cc[nH]c3cn2)CC1F.
What is the InChIKey of 2-fluoro-1-(1H-pyrrolo[2,3-c]pyridin-5-yl)cyclopropane-1-carboxamide?
The InChIKey is LXFFIEBIRMMPQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FN3O/c12-8-4-11(8,10(13)16)9-3-6-1-2-14-7(6)5-15-9/h1-3,5,8,14H,4H2,(H2,13,16).
What are the key properties of 2-fluoro-1-(1H-pyrrolo[2,3-c]pyridin-5-yl)cyclopropane-1-carboxamide?
2-fluoro-1-(1H-pyrrolo[2,3-c]pyridin-5-yl)cyclopropane-1-carboxamide has a molecular weight of 219.22 g/mol, XLogP of 1.03, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-1-(1H-pyrrolo[2,3-c]pyridin-5-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 175717705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).