4-chloro-N-[1-(furan-2-yl)ethyl]pyridine-2-carboxamide

C12H11ClN2O2 — CID 43399481

IUPAC4-chloro-N-[1-(furan-2-yl)ethyl]pyridine-2-carboxamide
SMILESCC(NC(=O)c1cc(Cl)ccn1)c1ccco1
InChIInChI=1S/C12H11ClN2O2/c1-8(11-3-2-6-17-11)15-12(16)10-7-9(13)4-5-14-10/h2-8H,1H3,(H,15,16)
InChIKeyPIJCBLGBUCPOHY-UHFFFAOYSA-N
MW250.69 g/mol
LogP2.82
Rot. Bonds3

About 4-chloro-N-[1-(furan-2-yl)ethyl]pyridine-2-carboxamide

4-chloro-N-[1-(furan-2-yl)ethyl]pyridine-2-carboxamide (PubChem CID 43399481) has the molecular formula C12H11ClN2O2 and a molecular weight of 250.69 g/mol. Its IUPAC name is 4-chloro-N-[1-(furan-2-yl)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-chloro-N-[1-(furan-2-yl)ethyl]pyridine-2-carboxamide
PubChem CID43399481
Molecular FormulaC12H11ClN2O2
Molecular Weight250.69 g/mol
Exact Mass250.05
IUPAC Name4-chloro-N-[1-(furan-2-yl)ethyl]pyridine-2-carboxamide
SMILESCC(NC(=O)c1cc(Cl)ccn1)c1ccco1
InChIInChI=1S/C12H11ClN2O2/c1-8(11-3-2-6-17-11)15-12(16)10-7-9(13)4-5-14-10/h2-8H,1H3,(H,15,16)
InChIKeyPIJCBLGBUCPOHY-UHFFFAOYSA-N
XLogP2.82
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.69
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-[1-(furan-2-yl)ethyl]pyrazine-2-carboxamide
CID 107238943
4-chloro-N-(1-thiophen-2-ylethyl)pyridine-2-carboxamide
CID 43398740
6-chloro-N-[1-(furan-2-yl)ethyl]pyrazine-2-carboxamide
CID 106550906
4-chloro-N-[1-(4-methylphenyl)ethyl]pyridine-2-carboxamide
CID 47161139
5-amino-N-[1-(furan-2-yl)ethyl]pyridine-2-carboxamide
CID 81316387
3,4-dichloro-N-[(1S)-1-(furan-2-yl)ethyl]benzamide
CID 7995956
6-[1-(furan-2-yl)ethylcarbamoyl]pyridine-3-carboxylic acid
CID 43429242
4-chloro-N-[1-(4-methoxyphenyl)ethyl]pyridine-2-carboxamide
CID 60739451
5,6-dichloro-N-[1-(furan-2-yl)ethyl]pyridine-3-carboxamide
CID 43399464
4-chloro-N-pentan-2-ylpyridine-2-carboxamide
CID 43087437
N-[1-(furan-2-yl)ethyl]-2-(methylamino)pyridine-4-carboxamide
CID 62168505
4-chloro-N-[1-(furan-2-yl)ethyl]-6-methylpyridine-3-carboxamide
CID 81225644

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[1-(furan-2-yl)ethyl]pyridine-2-carboxamide?
The IUPAC name of 4-chloro-N-[1-(furan-2-yl)ethyl]pyridine-2-carboxamide (CID 43399481) is 4-chloro-N-[1-(furan-2-yl)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for 4-chloro-N-[1-(furan-2-yl)ethyl]pyridine-2-carboxamide?
The canonical SMILES for 4-chloro-N-[1-(furan-2-yl)ethyl]pyridine-2-carboxamide is CC(NC(=O)c1cc(Cl)ccn1)c1ccco1.
What is the InChIKey of 4-chloro-N-[1-(furan-2-yl)ethyl]pyridine-2-carboxamide?
The InChIKey is PIJCBLGBUCPOHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2O2/c1-8(11-3-2-6-17-11)15-12(16)10-7-9(13)4-5-14-10/h2-8H,1H3,(H,15,16).
What are the key properties of 4-chloro-N-[1-(furan-2-yl)ethyl]pyridine-2-carboxamide?
4-chloro-N-[1-(furan-2-yl)ethyl]pyridine-2-carboxamide has a molecular weight of 250.69 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[1-(furan-2-yl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 43399481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).