3-(3-chlorophenyl)-N-[[2-(furan-2-yl)-3-pyridinyl]methyl]propanamide

C19H17ClN2O2 — CID 91630558

IUPAC3-(3-chlorophenyl)-N-[[2-(furan-2-yl)-3-pyridinyl]methyl]propanamide
SMILESO=C(CCc1cccc(Cl)c1)NCc1cccnc1-c1ccco1
InChIInChI=1S/C19H17ClN2O2/c20-16-6-1-4-14(12-16)8-9-18(23)22-13-15-5-2-10-21-19(15)17-7-3-11-24-17/h1-7,10-12H,8-9,13H2,(H,22,23)
InChIKeyKPRCKUNUSVREMD-UHFFFAOYSA-N
MW340.81 g/mol
LogP4.24
Rot. Bonds6

About 3-(3-chlorophenyl)-N-[[2-(furan-2-yl)-3-pyridinyl]methyl]propanamide

3-(3-chlorophenyl)-N-[[2-(furan-2-yl)-3-pyridinyl]methyl]propanamide (PubChem CID 91630558) has the molecular formula C19H17ClN2O2 and a molecular weight of 340.81 g/mol. Its IUPAC name is 3-(3-chlorophenyl)-N-[[2-(furan-2-yl)-3-pyridinyl]methyl]propanamide.

Molecular Properties

Compound Name3-(3-chlorophenyl)-N-[[2-(furan-2-yl)-3-pyridinyl]methyl]propanamide
PubChem CID91630558
Molecular FormulaC19H17ClN2O2
Molecular Weight340.81 g/mol
Exact Mass340.10
IUPAC Name3-(3-chlorophenyl)-N-[[2-(furan-2-yl)-3-pyridinyl]methyl]propanamide
SMILESO=C(CCc1cccc(Cl)c1)NCc1cccnc1-c1ccco1
InChIInChI=1S/C19H17ClN2O2/c20-16-6-1-4-14(12-16)8-9-18(23)22-13-15-5-2-10-21-19(15)17-7-3-11-24-17/h1-7,10-12H,8-9,13H2,(H,22,23)
InChIKeyKPRCKUNUSVREMD-UHFFFAOYSA-N
XLogP4.24
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.81
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-(furan-2-yl)-3-pyridinyl]methyl]-3-[(3-methylphenyl)sulfonylamino]propanamide
CID 91817264
2-cyclopentylsulfanyl-N-[[2-(furan-2-yl)-3-pyridinyl]methyl]acetamide
CID 91817271
[2-[(3-chlorophenyl)methylamino]-2-oxoethyl] furan-2-carboxylate
CID 7486670
3-(4-bromophenyl)-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]propanamide
CID 121198786
3-(3-chlorophenyl)-N-(2-pyridin-2-ylethyl)propanamide
CID 47141858
[2-(furan-2-yl)-3-pyridinyl]methanol
CID 91990185
3-(3,4-dichlorophenyl)-N-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]propanamide
CID 122275297
3-(2-aminophenyl)-N-[(3-chlorophenyl)methyl]propanamide
CID 107272767
3-(3-chlorophenyl)-N-(thiophen-2-ylmethyl)propanamide
CID 47129005
3-(3-chlorophenyl)-N-(thiophen-3-ylmethyl)propanamide
CID 91624486
N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-4-phenylbutanamide
CID 121198828
3-chloro-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]benzamide
CID 121198851

Frequently Asked Questions

What is the IUPAC name of 3-(3-chlorophenyl)-N-[[2-(furan-2-yl)-3-pyridinyl]methyl]propanamide?
The IUPAC name of 3-(3-chlorophenyl)-N-[[2-(furan-2-yl)-3-pyridinyl]methyl]propanamide (CID 91630558) is 3-(3-chlorophenyl)-N-[[2-(furan-2-yl)-3-pyridinyl]methyl]propanamide.
What is the SMILES notation for 3-(3-chlorophenyl)-N-[[2-(furan-2-yl)-3-pyridinyl]methyl]propanamide?
The canonical SMILES for 3-(3-chlorophenyl)-N-[[2-(furan-2-yl)-3-pyridinyl]methyl]propanamide is O=C(CCc1cccc(Cl)c1)NCc1cccnc1-c1ccco1.
What is the InChIKey of 3-(3-chlorophenyl)-N-[[2-(furan-2-yl)-3-pyridinyl]methyl]propanamide?
The InChIKey is KPRCKUNUSVREMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN2O2/c20-16-6-1-4-14(12-16)8-9-18(23)22-13-15-5-2-10-21-19(15)17-7-3-11-24-17/h1-7,10-12H,8-9,13H2,(H,22,23).
What are the key properties of 3-(3-chlorophenyl)-N-[[2-(furan-2-yl)-3-pyridinyl]methyl]propanamide?
3-(3-chlorophenyl)-N-[[2-(furan-2-yl)-3-pyridinyl]methyl]propanamide has a molecular weight of 340.81 g/mol, XLogP of 4.24, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-chlorophenyl)-N-[[2-(furan-2-yl)-3-pyridinyl]methyl]propanamide is sourced from PubChem (CID 91630558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).