6-(cyclopropylamino)-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide

C19H19N3O2S — CID 60563513

IUPAC6-(cyclopropylamino)-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
SMILESO=C(c1ccc(NC2CC2)nc1)N(Cc1ccco1)Cc1cccs1
InChIInChI=1S/C19H19N3O2S/c23-19(14-5-8-18(20-11-14)21-15-6-7-15)22(12-16-3-1-9-24-16)13-17-4-2-10-25-17/h1-5,8-11,15H,6-7,12-13H2,(H,20,21)
InChIKeyNWQWQYLQWGYRHG-UHFFFAOYSA-N
MW353.45 g/mol
LogP4.15
Rot. Bonds7

About 6-(cyclopropylamino)-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide

6-(cyclopropylamino)-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide (PubChem CID 60563513) has the molecular formula C19H19N3O2S and a molecular weight of 353.45 g/mol. Its IUPAC name is 6-(cyclopropylamino)-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(cyclopropylamino)-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
PubChem CID60563513
Molecular FormulaC19H19N3O2S
Molecular Weight353.45 g/mol
Exact Mass353.12
IUPAC Name6-(cyclopropylamino)-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
SMILESO=C(c1ccc(NC2CC2)nc1)N(Cc1ccco1)Cc1cccs1
InChIInChI=1S/C19H19N3O2S/c23-19(14-5-8-18(20-11-14)21-15-6-7-15)22(12-16-3-1-9-24-16)13-17-4-2-10-25-17/h1-5,8-11,15H,6-7,12-13H2,(H,20,21)
InChIKeyNWQWQYLQWGYRHG-UHFFFAOYSA-N
XLogP4.15
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.45
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(cyclopropylamino)-N,N-bis(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 60563556
N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)-1,3-benzothiazole-6-carboxamide
CID 18121711
3,5-dichloro-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)benzamide
CID 24529398
N-(furan-2-ylmethyl)-3-(pyrimidin-2-ylamino)-N-(thiophen-2-ylmethyl)benzamide
CID 31836707
N-ethyl-6-(ethylamino)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 62175204
N-(furan-2-ylmethyl)-1-methyl-6-oxo-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 75461194
2-fluoro-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)benzamide
CID 78789331
N-(furan-2-ylmethyl)-4-(tetrazol-1-yl)-N-(thiophen-2-ylmethyl)benzamide
CID 31834240
4-(difluoromethylsulfonyl)-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)benzamide
CID 9094982
3-ethoxy-N-(furan-2-ylmethyl)-4-methoxy-N-(thiophen-2-ylmethyl)benzamide
CID 31833854
3-[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]-3-oxopropanoic acid
CID 62232437
3-ethoxy-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)benzamide
CID 35526706

Frequently Asked Questions

What is the IUPAC name of 6-(cyclopropylamino)-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of 6-(cyclopropylamino)-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide (CID 60563513) is 6-(cyclopropylamino)-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(cyclopropylamino)-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(cyclopropylamino)-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide is O=C(c1ccc(NC2CC2)nc1)N(Cc1ccco1)Cc1cccs1.
What is the InChIKey of 6-(cyclopropylamino)-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide?
The InChIKey is NWQWQYLQWGYRHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2S/c23-19(14-5-8-18(20-11-14)21-15-6-7-15)22(12-16-3-1-9-24-16)13-17-4-2-10-25-17/h1-5,8-11,15H,6-7,12-13H2,(H,20,21).
What are the key properties of 6-(cyclopropylamino)-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide?
6-(cyclopropylamino)-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide has a molecular weight of 353.45 g/mol, XLogP of 4.15, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopropylamino)-N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 60563513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).