N-(furan-2-ylmethyl)-4-(2-methylanilino)pyridine-2-carboxamide

C18H17N3O2 — CID 109209341

IUPACN-(furan-2-ylmethyl)-4-(2-methylanilino)pyridine-2-carboxamide
SMILESCc1ccccc1Nc1ccnc(C(=O)NCc2ccco2)c1
InChIInChI=1S/C18H17N3O2/c1-13-5-2-3-7-16(13)21-14-8-9-19-17(11-14)18(22)20-12-15-6-4-10-23-15/h2-11H,12H2,1H3,(H,19,21)(H,20,22)
InChIKeyPQCBBMJCYJKHBG-UHFFFAOYSA-N
MW307.35 g/mol
LogP3.66
Rot. Bonds5

About N-(furan-2-ylmethyl)-4-(2-methylanilino)pyridine-2-carboxamide

N-(furan-2-ylmethyl)-4-(2-methylanilino)pyridine-2-carboxamide (PubChem CID 109209341) has the molecular formula C18H17N3O2 and a molecular weight of 307.35 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-4-(2-methylanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-4-(2-methylanilino)pyridine-2-carboxamide
PubChem CID109209341
Molecular FormulaC18H17N3O2
Molecular Weight307.35 g/mol
Exact Mass307.13
IUPAC NameN-(furan-2-ylmethyl)-4-(2-methylanilino)pyridine-2-carboxamide
SMILESCc1ccccc1Nc1ccnc(C(=O)NCc2ccco2)c1
InChIInChI=1S/C18H17N3O2/c1-13-5-2-3-7-16(13)21-14-8-9-19-17(11-14)18(22)20-12-15-6-4-10-23-15/h2-11H,12H2,1H3,(H,19,21)(H,20,22)
InChIKeyPQCBBMJCYJKHBG-UHFFFAOYSA-N
XLogP3.66
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 53.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-acetamidoanilino)-N-(furan-2-ylmethyl)pyridine-2-carboxamide
CID 109209396
4-(2-methylanilino)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 109212998
N-(furan-2-ylmethyl)-2-methyl-6-(2-methylanilino)pyrimidine-4-carboxamide
CID 109368133
4-(3,4-difluoroanilino)-N-(furan-2-ylmethyl)pyridine-2-carboxamide
CID 109209444
4-(1,3-benzodioxol-5-ylamino)-N-(furan-2-ylmethyl)pyridine-2-carboxamide
CID 109209418
4-(3-cyanoanilino)-N-(furan-2-ylmethyl)pyridine-2-carboxamide
CID 109209439
4-[2-(dimethylamino)ethylamino]-N-(furan-2-ylmethyl)pyridine-2-carboxamide
CID 109207271
N,N-diethyl-4-(2-methylanilino)pyridine-2-carboxamide
CID 109216389
4-N-(3,5-dimethylphenyl)-2-N-(furan-2-ylmethyl)pyridine-2,4-dicarboxamide
CID 109085201
N-(3,4-dimethylphenyl)-4-(2-methylanilino)pyridine-2-carboxamide
CID 109219004
4-(2-methylanilino)-N-[2-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 109219031
5-(2-ethylanilino)-N-(furan-2-ylmethyl)pyridine-2-carboxamide
CID 109187557

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-4-(2-methylanilino)pyridine-2-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-4-(2-methylanilino)pyridine-2-carboxamide (CID 109209341) is N-(furan-2-ylmethyl)-4-(2-methylanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-4-(2-methylanilino)pyridine-2-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-4-(2-methylanilino)pyridine-2-carboxamide is Cc1ccccc1Nc1ccnc(C(=O)NCc2ccco2)c1.
What is the InChIKey of N-(furan-2-ylmethyl)-4-(2-methylanilino)pyridine-2-carboxamide?
The InChIKey is PQCBBMJCYJKHBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2/c1-13-5-2-3-7-16(13)21-14-8-9-19-17(11-14)18(22)20-12-15-6-4-10-23-15/h2-11H,12H2,1H3,(H,19,21)(H,20,22).
What are the key properties of N-(furan-2-ylmethyl)-4-(2-methylanilino)pyridine-2-carboxamide?
N-(furan-2-ylmethyl)-4-(2-methylanilino)pyridine-2-carboxamide has a molecular weight of 307.35 g/mol, XLogP of 3.66, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-4-(2-methylanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109209341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).