3-(4-chloroanilino)-N-(2-hydroxypropyl)furo[2,3-c]pyridine-2-carboxamide

C17H16ClN3O3 — CID 58826867

IUPAC3-(4-chloroanilino)-N-(2-hydroxypropyl)furo[2,3-c]pyridine-2-carboxamide
SMILESCC(O)CNC(=O)c1oc2cnccc2c1Nc1ccc(Cl)cc1
InChIInChI=1S/C17H16ClN3O3/c1-10(22)8-20-17(23)16-15(13-6-7-19-9-14(13)24-16)21-12-4-2-11(18)3-5-12/h2-7,9-10,21-22H,8H2,1H3,(H,20,23)
InChIKeyQAEPRJGRNPWZQY-UHFFFAOYSA-N
MW345.79 g/mol
LogP3.34
Rot. Bonds5

About 3-(4-chloroanilino)-N-(2-hydroxypropyl)furo[2,3-c]pyridine-2-carboxamide

3-(4-chloroanilino)-N-(2-hydroxypropyl)furo[2,3-c]pyridine-2-carboxamide (PubChem CID 58826867) has the molecular formula C17H16ClN3O3 and a molecular weight of 345.79 g/mol. Its IUPAC name is 3-(4-chloroanilino)-N-(2-hydroxypropyl)furo[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-(4-chloroanilino)-N-(2-hydroxypropyl)furo[2,3-c]pyridine-2-carboxamide
PubChem CID58826867
Molecular FormulaC17H16ClN3O3
Molecular Weight345.79 g/mol
Exact Mass345.09
IUPAC Name3-(4-chloroanilino)-N-(2-hydroxypropyl)furo[2,3-c]pyridine-2-carboxamide
SMILESCC(O)CNC(=O)c1oc2cnccc2c1Nc1ccc(Cl)cc1
InChIInChI=1S/C17H16ClN3O3/c1-10(22)8-20-17(23)16-15(13-6-7-19-9-14(13)24-16)21-12-4-2-11(18)3-5-12/h2-7,9-10,21-22H,8H2,1H3,(H,20,23)
InChIKeyQAEPRJGRNPWZQY-UHFFFAOYSA-N
XLogP3.34
TPSA87.39 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.79
LogP ≤ 53.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

3-chloro-N-[(2S)-2-hydroxypropyl]pyridine-4-carboxamide
CID 83030867
3-[(1-hydroxyimino-2,3-dihydroinden-5-yl)amino]-N-(pyrimidin-2-ylmethyl)furo[2,3-c]pyridine-2-carboxamide
CID 73225914
3-(1,4-dihydroindeno[2,1-d]pyrazol-6-ylamino)-N-propan-2-ylfuro[2,3-c]pyridine-2-carboxamide
CID 53320630
4-amino-N-(2-hydroxypropyl)pyridine-3-carboxamide
CID 123975381
3-[(1-nitroso-2,3-dihydro-1H-inden-5-yl)amino]-N-(pyrimidin-2-ylmethyl)furo[2,3-c]pyridine-2-carboxamide
CID 91137476
3-[(1-imino-2,3-dihydroinden-5-yl)amino]-N-(2-morpholin-4-ylethyl)furo[2,3-c]pyridine-2-carboxamide
CID 89376347
3-[(1-imino-2,3-dihydroinden-5-yl)amino]-N-(2-piperidin-1-ylethyl)furo[2,3-c]pyridine-2-carboxamide
CID 89376332
N-(2,3-dihydroxypropyl)-3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridine-2-carboxamide;ethane
CID 143636219
CID 162504415
CID 162504415
3-(4-methylanilino)furo[3,2-c]pyridine-2-carboxamide
CID 143636123
4-[[6-(5-chloro-2-fluorophenyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]-N-[(2S)-2-hydroxypropyl]pyridine-3-carboxamide
CID 155532120
N-[(2S)-2-hydroxypropyl]pyridine-3-carboxamide
CID 39237258

Frequently Asked Questions

What is the IUPAC name of 3-(4-chloroanilino)-N-(2-hydroxypropyl)furo[2,3-c]pyridine-2-carboxamide?
The IUPAC name of 3-(4-chloroanilino)-N-(2-hydroxypropyl)furo[2,3-c]pyridine-2-carboxamide (CID 58826867) is 3-(4-chloroanilino)-N-(2-hydroxypropyl)furo[2,3-c]pyridine-2-carboxamide.
What is the SMILES notation for 3-(4-chloroanilino)-N-(2-hydroxypropyl)furo[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for 3-(4-chloroanilino)-N-(2-hydroxypropyl)furo[2,3-c]pyridine-2-carboxamide is CC(O)CNC(=O)c1oc2cnccc2c1Nc1ccc(Cl)cc1.
What is the InChIKey of 3-(4-chloroanilino)-N-(2-hydroxypropyl)furo[2,3-c]pyridine-2-carboxamide?
The InChIKey is QAEPRJGRNPWZQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16ClN3O3/c1-10(22)8-20-17(23)16-15(13-6-7-19-9-14(13)24-16)21-12-4-2-11(18)3-5-12/h2-7,9-10,21-22H,8H2,1H3,(H,20,23).
What are the key properties of 3-(4-chloroanilino)-N-(2-hydroxypropyl)furo[2,3-c]pyridine-2-carboxamide?
3-(4-chloroanilino)-N-(2-hydroxypropyl)furo[2,3-c]pyridine-2-carboxamide has a molecular weight of 345.79 g/mol, XLogP of 3.34, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chloroanilino)-N-(2-hydroxypropyl)furo[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 58826867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).