2-chloro-N-(1-piperidin-1-ylpropan-2-yl)furan-3-carboxamide

C13H19ClN2O2 — CID 106685808

IUPAC2-chloro-N-(1-piperidin-1-ylpropan-2-yl)furan-3-carboxamide
SMILESCC(CN1CCCCC1)NC(=O)c1ccoc1Cl
InChIInChI=1S/C13H19ClN2O2/c1-10(9-16-6-3-2-4-7-16)15-13(17)11-5-8-18-12(11)14/h5,8,10H,2-4,6-7,9H2,1H3,(H,15,17)
InChIKeyXJESJGUQJQVIEE-UHFFFAOYSA-N
MW270.76 g/mol
LogP2.54
Rot. Bonds4

About 2-chloro-N-(1-piperidin-1-ylpropan-2-yl)furan-3-carboxamide

2-chloro-N-(1-piperidin-1-ylpropan-2-yl)furan-3-carboxamide (PubChem CID 106685808) has the molecular formula C13H19ClN2O2 and a molecular weight of 270.76 g/mol. Its IUPAC name is 2-chloro-N-(1-piperidin-1-ylpropan-2-yl)furan-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-(1-piperidin-1-ylpropan-2-yl)furan-3-carboxamide
PubChem CID106685808
Molecular FormulaC13H19ClN2O2
Molecular Weight270.76 g/mol
Exact Mass270.11
IUPAC Name2-chloro-N-(1-piperidin-1-ylpropan-2-yl)furan-3-carboxamide
SMILESCC(CN1CCCCC1)NC(=O)c1ccoc1Cl
InChIInChI=1S/C13H19ClN2O2/c1-10(9-16-6-3-2-4-7-16)15-13(17)11-5-8-18-12(11)14/h5,8,10H,2-4,6-7,9H2,1H3,(H,15,17)
InChIKeyXJESJGUQJQVIEE-UHFFFAOYSA-N
XLogP2.54
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.76
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-(2-methyl-3-pyrrolidin-1-ylpropyl)furan-3-carboxamide
CID 106686782
2-chloro-N-[(2S)-1-hydroxypropan-2-yl]furan-3-carboxamide
CID 106688386
5-chloro-2-hydroxy-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide
CID 61217192
4-amino-2-chloro-N-(1-piperidin-1-ylpropan-2-yl)benzamide;dihydrochloride
CID 119851476
2-amino-4-chloro-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide
CID 61471794
2-chloro-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridine-4-carboxamide
CID 61217354
5-chloro-N-(1-piperidin-1-ylpropan-2-yl)-1,3,4-thiadiazole-2-carboxamide
CID 80625100
2-hydroxy-3-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide
CID 61217194
3-hydroxy-2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)benzamide
CID 82828949
2-chloro-5-hydroxy-N-(1-morpholin-4-ylpropan-2-yl)benzamide
CID 106501557
6-chloro-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrazine-2-carboxamide
CID 114035318
2-chloro-N-[4-(pyrrolidin-1-ylmethyl)phenyl]furan-3-carboxamide
CID 106685912

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(1-piperidin-1-ylpropan-2-yl)furan-3-carboxamide?
The IUPAC name of 2-chloro-N-(1-piperidin-1-ylpropan-2-yl)furan-3-carboxamide (CID 106685808) is 2-chloro-N-(1-piperidin-1-ylpropan-2-yl)furan-3-carboxamide.
What is the SMILES notation for 2-chloro-N-(1-piperidin-1-ylpropan-2-yl)furan-3-carboxamide?
The canonical SMILES for 2-chloro-N-(1-piperidin-1-ylpropan-2-yl)furan-3-carboxamide is CC(CN1CCCCC1)NC(=O)c1ccoc1Cl.
What is the InChIKey of 2-chloro-N-(1-piperidin-1-ylpropan-2-yl)furan-3-carboxamide?
The InChIKey is XJESJGUQJQVIEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19ClN2O2/c1-10(9-16-6-3-2-4-7-16)15-13(17)11-5-8-18-12(11)14/h5,8,10H,2-4,6-7,9H2,1H3,(H,15,17).
What are the key properties of 2-chloro-N-(1-piperidin-1-ylpropan-2-yl)furan-3-carboxamide?
2-chloro-N-(1-piperidin-1-ylpropan-2-yl)furan-3-carboxamide has a molecular weight of 270.76 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(1-piperidin-1-ylpropan-2-yl)furan-3-carboxamide is sourced from PubChem (CID 106685808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).