N-cyclopentyl-2-methyl-N-(2-phenylethyl)furan-3-carboxamide

C19H23NO2 — CID 52574458

IUPACN-cyclopentyl-2-methyl-N-(2-phenylethyl)furan-3-carboxamide
SMILESCc1occc1C(=O)N(CCc1ccccc1)C1CCCC1
InChIInChI=1S/C19H23NO2/c1-15-18(12-14-22-15)19(21)20(17-9-5-6-10-17)13-11-16-7-3-2-4-8-16/h2-4,7-8,12,14,17H,5-6,9-11,13H2,1H3
InChIKeySCECNIXNXZZNSK-UHFFFAOYSA-N
MW297.40 g/mol
LogP4.22
Rot. Bonds5

About N-cyclopentyl-2-methyl-N-(2-phenylethyl)furan-3-carboxamide

N-cyclopentyl-2-methyl-N-(2-phenylethyl)furan-3-carboxamide (PubChem CID 52574458) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-cyclopentyl-2-methyl-N-(2-phenylethyl)furan-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-2-methyl-N-(2-phenylethyl)furan-3-carboxamide
PubChem CID52574458
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC NameN-cyclopentyl-2-methyl-N-(2-phenylethyl)furan-3-carboxamide
SMILESCc1occc1C(=O)N(CCc1ccccc1)C1CCCC1
InChIInChI=1S/C19H23NO2/c1-15-18(12-14-22-15)19(21)20(17-9-5-6-10-17)13-11-16-7-3-2-4-8-16/h2-4,7-8,12,14,17H,5-6,9-11,13H2,1H3
InChIKeySCECNIXNXZZNSK-UHFFFAOYSA-N
XLogP4.22
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-methyl-N-(2-phenylethyl)furan-3-carboxamide?
The IUPAC name of N-cyclopentyl-2-methyl-N-(2-phenylethyl)furan-3-carboxamide (CID 52574458) is N-cyclopentyl-2-methyl-N-(2-phenylethyl)furan-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-2-methyl-N-(2-phenylethyl)furan-3-carboxamide?
The canonical SMILES for N-cyclopentyl-2-methyl-N-(2-phenylethyl)furan-3-carboxamide is Cc1occc1C(=O)N(CCc1ccccc1)C1CCCC1.
What is the InChIKey of N-cyclopentyl-2-methyl-N-(2-phenylethyl)furan-3-carboxamide?
The InChIKey is SCECNIXNXZZNSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-15-18(12-14-22-15)19(21)20(17-9-5-6-10-17)13-11-16-7-3-2-4-8-16/h2-4,7-8,12,14,17H,5-6,9-11,13H2,1H3.
What are the key properties of N-cyclopentyl-2-methyl-N-(2-phenylethyl)furan-3-carboxamide?
N-cyclopentyl-2-methyl-N-(2-phenylethyl)furan-3-carboxamide has a molecular weight of 297.40 g/mol, XLogP of 4.22, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-methyl-N-(2-phenylethyl)furan-3-carboxamide is sourced from PubChem (CID 52574458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).