2-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide

C14H14ClNO3 — CID 71782549

IUPAC2-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide
SMILESCC(O)(CNC(=O)c1ccccc1Cl)c1ccco1
InChIInChI=1S/C14H14ClNO3/c1-14(18,12-7-4-8-19-12)9-16-13(17)10-5-2-3-6-11(10)15/h2-8,18H,9H2,1H3,(H,16,17)
InChIKeyPAMDVZHMQHWQOZ-UHFFFAOYSA-N
MW279.72 g/mol
LogP2.57
Rot. Bonds4

About 2-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide

2-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide (PubChem CID 71782549) has the molecular formula C14H14ClNO3 and a molecular weight of 279.72 g/mol. Its IUPAC name is 2-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide
PubChem CID71782549
Molecular FormulaC14H14ClNO3
Molecular Weight279.72 g/mol
Exact Mass279.07
IUPAC Name2-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide
SMILESCC(O)(CNC(=O)c1ccccc1Cl)c1ccco1
InChIInChI=1S/C14H14ClNO3/c1-14(18,12-7-4-8-19-12)9-16-13(17)10-5-2-3-6-11(10)15/h2-8,18H,9H2,1H3,(H,16,17)
InChIKeyPAMDVZHMQHWQOZ-UHFFFAOYSA-N
XLogP2.57
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.72
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]pyridine-4-carboxamide
CID 111519619
2,6-dichloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide
CID 71975267
N-[2-(furan-2-yl)-2-hydroxypropyl]naphthalene-1-carboxamide
CID 71782562
N-[(2S)-2-(furan-2-yl)-2-hydroxypropyl]-2-methoxybenzamide
CID 95983592
N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide
CID 111482452
2,4-dichloro-N-[(2R)-2-(furan-2-yl)-2-hydroxypropyl]-5-methylsulfanylbenzamide
CID 97321033
5-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]furan-2-carboxamide
CID 111482154
N-[(2S)-2-(furan-2-yl)-2-hydroxypropyl]-4-phenylbenzamide
CID 95983664
2-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]pyridine-4-carboxamide
CID 111482264
N-[2-(furan-2-yl)-2-hydroxypropyl]-5-phenyl-1H-pyrazole-4-carboxamide
CID 111482271
methyl N-[2-(furan-2-yl)-2-hydroxypropyl]carbamate
CID 121085806
2-bromo-N-[2-(furan-2-yl)-2-hydroxypropyl]-6-methylpyridine-3-carboxamide
CID 109477092

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide?
The IUPAC name of 2-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide (CID 71782549) is 2-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide.
What is the SMILES notation for 2-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide?
The canonical SMILES for 2-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide is CC(O)(CNC(=O)c1ccccc1Cl)c1ccco1.
What is the InChIKey of 2-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide?
The InChIKey is PAMDVZHMQHWQOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClNO3/c1-14(18,12-7-4-8-19-12)9-16-13(17)10-5-2-3-6-11(10)15/h2-8,18H,9H2,1H3,(H,16,17).
What are the key properties of 2-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide?
2-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide has a molecular weight of 279.72 g/mol, XLogP of 2.57, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[2-(furan-2-yl)-2-hydroxypropyl]benzamide is sourced from PubChem (CID 71782549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).