N-[1-(furan-2-yl)ethyl]-4-methyl-N-pyridin-2-ylbenzamide

C19H18N2O2 — CID 2999707

IUPACN-[1-(furan-2-yl)ethyl]-4-methyl-N-pyridin-2-ylbenzamide
SMILESCc1ccc(C(=O)N(c2ccccn2)C(C)c2ccco2)cc1
InChIInChI=1S/C19H18N2O2/c1-14-8-10-16(11-9-14)19(22)21(18-7-3-4-12-20-18)15(2)17-6-5-13-23-17/h3-13,15H,1-2H3
InChIKeyWLCCBPXXWAARAK-UHFFFAOYSA-N
MW306.37 g/mol
LogP4.39
Rot. Bonds4

About N-[1-(furan-2-yl)ethyl]-4-methyl-N-pyridin-2-ylbenzamide

N-[1-(furan-2-yl)ethyl]-4-methyl-N-pyridin-2-ylbenzamide (PubChem CID 2999707) has the molecular formula C19H18N2O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is N-[1-(furan-2-yl)ethyl]-4-methyl-N-pyridin-2-ylbenzamide.

Molecular Properties

Compound NameN-[1-(furan-2-yl)ethyl]-4-methyl-N-pyridin-2-ylbenzamide
PubChem CID2999707
Molecular FormulaC19H18N2O2
Molecular Weight306.37 g/mol
Exact Mass306.14
IUPAC NameN-[1-(furan-2-yl)ethyl]-4-methyl-N-pyridin-2-ylbenzamide
SMILESCc1ccc(C(=O)N(c2ccccn2)C(C)c2ccco2)cc1
InChIInChI=1S/C19H18N2O2/c1-14-8-10-16(11-9-14)19(22)21(18-7-3-4-12-20-18)15(2)17-6-5-13-23-17/h3-13,15H,1-2H3
InChIKeyWLCCBPXXWAARAK-UHFFFAOYSA-N
XLogP4.39
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-yl)ethyl]-4-methyl-N-pyridin-2-ylbenzamide?
The IUPAC name of N-[1-(furan-2-yl)ethyl]-4-methyl-N-pyridin-2-ylbenzamide (CID 2999707) is N-[1-(furan-2-yl)ethyl]-4-methyl-N-pyridin-2-ylbenzamide.
What is the SMILES notation for N-[1-(furan-2-yl)ethyl]-4-methyl-N-pyridin-2-ylbenzamide?
The canonical SMILES for N-[1-(furan-2-yl)ethyl]-4-methyl-N-pyridin-2-ylbenzamide is Cc1ccc(C(=O)N(c2ccccn2)C(C)c2ccco2)cc1.
What is the InChIKey of N-[1-(furan-2-yl)ethyl]-4-methyl-N-pyridin-2-ylbenzamide?
The InChIKey is WLCCBPXXWAARAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O2/c1-14-8-10-16(11-9-14)19(22)21(18-7-3-4-12-20-18)15(2)17-6-5-13-23-17/h3-13,15H,1-2H3.
What are the key properties of N-[1-(furan-2-yl)ethyl]-4-methyl-N-pyridin-2-ylbenzamide?
N-[1-(furan-2-yl)ethyl]-4-methyl-N-pyridin-2-ylbenzamide has a molecular weight of 306.37 g/mol, XLogP of 4.39, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-yl)ethyl]-4-methyl-N-pyridin-2-ylbenzamide is sourced from PubChem (CID 2999707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).