N-[(7-fluoro-1H-pyrrolo[3,2-c]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide

C13H15FN4O — CID 166139699

IUPACN-[(7-fluoro-1H-pyrrolo[3,2-c]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide
SMILESO=C(NCc1cc2cncc(F)c2[nH]1)C1CCCN1
InChIInChI=1S/C13H15FN4O/c14-10-7-15-5-8-4-9(18-12(8)10)6-17-13(19)11-2-1-3-16-11/h4-5,7,11,16,18H,1-3,6H2,(H,17,19)
InChIKeyIWGCOVLAXRSKLT-UHFFFAOYSA-N
MW262.29 g/mol
LogP1.07
Rot. Bonds3

About N-[(7-fluoro-1H-pyrrolo[3,2-c]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide

N-[(7-fluoro-1H-pyrrolo[3,2-c]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide (PubChem CID 166139699) has the molecular formula C13H15FN4O and a molecular weight of 262.29 g/mol. Its IUPAC name is N-[(7-fluoro-1H-pyrrolo[3,2-c]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-[(7-fluoro-1H-pyrrolo[3,2-c]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide
PubChem CID166139699
Molecular FormulaC13H15FN4O
Molecular Weight262.29 g/mol
Exact Mass262.12
IUPAC NameN-[(7-fluoro-1H-pyrrolo[3,2-c]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide
SMILESO=C(NCc1cc2cncc(F)c2[nH]1)C1CCCN1
InChIInChI=1S/C13H15FN4O/c14-10-7-15-5-8-4-9(18-12(8)10)6-17-13(19)11-2-1-3-16-11/h4-5,7,11,16,18H,1-3,6H2,(H,17,19)
InChIKeyIWGCOVLAXRSKLT-UHFFFAOYSA-N
XLogP1.07
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.29
LogP ≤ 51.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2,4-difluorophenyl)methyl]pyrrolidine-2-carboxamide
CID 60737551
N-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide
CID 43094683
N-[(2,5-difluorophenyl)methyl]piperidine-2-carboxamide
CID 63795889
N-[[4-fluoro-3-(hydroxymethyl)phenyl]methyl]pyrrolidine-2-carboxamide
CID 110012377
(2S)-N-[(6-fluoro-1H-benzimidazol-2-yl)methyl]pyrrolidine-2-carboxamide;hydrochloride
CID 122081687
N-[(4-fluorophenyl)methyl]piperidine-2-carboxamide
CID 11615609
(2S)-N-[[6-fluoro-4-[5-(trifluoromethyl)-2-pyridinyl]-2-pyridinyl]methyl]pyrrolidine-2-carboxamide
CID 144826207
(2R)-N-(2,3,5,6-tetrafluorophenyl)pyrrolidine-2-carboxamide
CID 107641757
(2S)-N-[2-(1H-imidazol-5-yl)ethyl]pyrrolidine-2-carboxamide
CID 15296546
(2S)-N-[(4-fluoro-3,5-dimethylphenyl)methyl]piperidine-2-carboxamide
CID 103812920
(2S)-N-[[4-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119275122
N-(quinolin-3-ylmethyl)pyrrolidine-2-carboxamide;dihydrochloride
CID 119855878

Frequently Asked Questions

What is the IUPAC name of N-[(7-fluoro-1H-pyrrolo[3,2-c]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide?
The IUPAC name of N-[(7-fluoro-1H-pyrrolo[3,2-c]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide (CID 166139699) is N-[(7-fluoro-1H-pyrrolo[3,2-c]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for N-[(7-fluoro-1H-pyrrolo[3,2-c]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide?
The canonical SMILES for N-[(7-fluoro-1H-pyrrolo[3,2-c]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide is O=C(NCc1cc2cncc(F)c2[nH]1)C1CCCN1.
What is the InChIKey of N-[(7-fluoro-1H-pyrrolo[3,2-c]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide?
The InChIKey is IWGCOVLAXRSKLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15FN4O/c14-10-7-15-5-8-4-9(18-12(8)10)6-17-13(19)11-2-1-3-16-11/h4-5,7,11,16,18H,1-3,6H2,(H,17,19).
What are the key properties of N-[(7-fluoro-1H-pyrrolo[3,2-c]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide?
N-[(7-fluoro-1H-pyrrolo[3,2-c]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide has a molecular weight of 262.29 g/mol, XLogP of 1.07, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(7-fluoro-1H-pyrrolo[3,2-c]pyridin-2-yl)methyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 166139699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).