N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]-N-(thiophen-2-ylmethyl)furan-2-carboxamide

C19H18N2O3S — CID 37483914

IUPACN-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]-N-(thiophen-2-ylmethyl)furan-2-carboxamide
SMILESO=C(c1ccc(Cn2ccccc2=O)o1)N(Cc1cccs1)C1CC1
InChIInChI=1S/C19H18N2O3S/c22-18-5-1-2-10-20(18)12-15-8-9-17(24-15)19(23)21(14-6-7-14)13-16-4-3-11-25-16/h1-5,8-11,14H,6-7,12-13H2
InChIKeyWNBZGQFIUQCOEQ-UHFFFAOYSA-N
MW354.43 g/mol
LogP3.36
Rot. Bonds6

About N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]-N-(thiophen-2-ylmethyl)furan-2-carboxamide

N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]-N-(thiophen-2-ylmethyl)furan-2-carboxamide (PubChem CID 37483914) has the molecular formula C19H18N2O3S and a molecular weight of 354.43 g/mol. Its IUPAC name is N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]-N-(thiophen-2-ylmethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]-N-(thiophen-2-ylmethyl)furan-2-carboxamide
PubChem CID37483914
Molecular FormulaC19H18N2O3S
Molecular Weight354.43 g/mol
Exact Mass354.10
IUPAC NameN-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]-N-(thiophen-2-ylmethyl)furan-2-carboxamide
SMILESO=C(c1ccc(Cn2ccccc2=O)o1)N(Cc1cccs1)C1CC1
InChIInChI=1S/C19H18N2O3S/c22-18-5-1-2-10-20(18)12-15-8-9-17(24-15)19(23)21(14-6-7-14)13-16-4-3-11-25-16/h1-5,8-11,14H,6-7,12-13H2
InChIKeyWNBZGQFIUQCOEQ-UHFFFAOYSA-N
XLogP3.36
TPSA55.45 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.43
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]-N-(thiophen-2-ylmethyl)furan-2-carboxamide?
The IUPAC name of N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]-N-(thiophen-2-ylmethyl)furan-2-carboxamide (CID 37483914) is N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]-N-(thiophen-2-ylmethyl)furan-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]-N-(thiophen-2-ylmethyl)furan-2-carboxamide?
The canonical SMILES for N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]-N-(thiophen-2-ylmethyl)furan-2-carboxamide is O=C(c1ccc(Cn2ccccc2=O)o1)N(Cc1cccs1)C1CC1.
What is the InChIKey of N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]-N-(thiophen-2-ylmethyl)furan-2-carboxamide?
The InChIKey is WNBZGQFIUQCOEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3S/c22-18-5-1-2-10-20(18)12-15-8-9-17(24-15)19(23)21(14-6-7-14)13-16-4-3-11-25-16/h1-5,8-11,14H,6-7,12-13H2.
What are the key properties of N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]-N-(thiophen-2-ylmethyl)furan-2-carboxamide?
N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]-N-(thiophen-2-ylmethyl)furan-2-carboxamide has a molecular weight of 354.43 g/mol, XLogP of 3.36, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-[(2-oxo-1-pyridinyl)methyl]-N-(thiophen-2-ylmethyl)furan-2-carboxamide is sourced from PubChem (CID 37483914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).