3-(furan-2-yl)-N-[2-(3-methylphenyl)ethyl]propanamide

C16H19NO2 — CID 110307624

IUPAC3-(furan-2-yl)-N-[2-(3-methylphenyl)ethyl]propanamide
SMILESCc1cccc(CCNC(=O)CCc2ccco2)c1
InChIInChI=1S/C16H19NO2/c1-13-4-2-5-14(12-13)9-10-17-16(18)8-7-15-6-3-11-19-15/h2-6,11-12H,7-10H2,1H3,(H,17,18)
InChIKeyCIKYYWPTURLEGQ-UHFFFAOYSA-N
MW257.33 g/mol
LogP2.88
Rot. Bonds6

About 3-(furan-2-yl)-N-[2-(3-methylphenyl)ethyl]propanamide

3-(furan-2-yl)-N-[2-(3-methylphenyl)ethyl]propanamide (PubChem CID 110307624) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is 3-(furan-2-yl)-N-[2-(3-methylphenyl)ethyl]propanamide.

Molecular Properties

Compound Name3-(furan-2-yl)-N-[2-(3-methylphenyl)ethyl]propanamide
PubChem CID110307624
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC Name3-(furan-2-yl)-N-[2-(3-methylphenyl)ethyl]propanamide
SMILESCc1cccc(CCNC(=O)CCc2ccco2)c1
InChIInChI=1S/C16H19NO2/c1-13-4-2-5-14(12-13)9-10-17-16(18)8-7-15-6-3-11-19-15/h2-6,11-12H,7-10H2,1H3,(H,17,18)
InChIKeyCIKYYWPTURLEGQ-UHFFFAOYSA-N
XLogP2.88
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-aminophenyl)-N-[2-(3-methylphenyl)ethyl]propanamide
CID 62314321
3-(furan-2-yl)-N-[[3-[[3-(furan-2-yl)propanoylamino]methyl]phenyl]methyl]propanamide
CID 86064144
3-acetamido-N-[2-(3-methylphenyl)ethyl]propanamide
CID 110354308
N-[2-(furan-2-yl)ethyl]-2-(3-methylphenoxy)acetamide
CID 110733552
N-(furan-2-ylmethyl)-2-(3-methylphenyl)acetamide
CID 6466784
5-[2-(3-methylphenyl)ethylamino]-5-oxopentanoic acid
CID 62314996
5-hydroxy-N-[2-(3-methylphenyl)ethyl]pentanamide
CID 79199375
6-[2-(3-methylphenyl)ethylamino]-6-oxohexanoic acid
CID 62315187
N-(2-aminoethyl)-3-(furan-2-yl)propanamide
CID 28779702
4-(methylamino)-N-[2-(3-methylphenyl)ethyl]butanamide;hydrochloride
CID 119745493
2-(furan-2-yl)-N-[(3-methylphenyl)methyl]acetamide
CID 110690605
N-ethyl-3-(furan-2-yl)propanamide
CID 60690706

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-N-[2-(3-methylphenyl)ethyl]propanamide?
The IUPAC name of 3-(furan-2-yl)-N-[2-(3-methylphenyl)ethyl]propanamide (CID 110307624) is 3-(furan-2-yl)-N-[2-(3-methylphenyl)ethyl]propanamide.
What is the SMILES notation for 3-(furan-2-yl)-N-[2-(3-methylphenyl)ethyl]propanamide?
The canonical SMILES for 3-(furan-2-yl)-N-[2-(3-methylphenyl)ethyl]propanamide is Cc1cccc(CCNC(=O)CCc2ccco2)c1.
What is the InChIKey of 3-(furan-2-yl)-N-[2-(3-methylphenyl)ethyl]propanamide?
The InChIKey is CIKYYWPTURLEGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-13-4-2-5-14(12-13)9-10-17-16(18)8-7-15-6-3-11-19-15/h2-6,11-12H,7-10H2,1H3,(H,17,18).
What are the key properties of 3-(furan-2-yl)-N-[2-(3-methylphenyl)ethyl]propanamide?
3-(furan-2-yl)-N-[2-(3-methylphenyl)ethyl]propanamide has a molecular weight of 257.33 g/mol, XLogP of 2.88, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-N-[2-(3-methylphenyl)ethyl]propanamide is sourced from PubChem (CID 110307624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).