2-(3,4-dimethylanilino)-N-(furan-2-ylmethyl)-6-methylpyrimidine-4-carboxamide

C19H20N4O2 — CID 109326984

IUPAC2-(3,4-dimethylanilino)-N-(furan-2-ylmethyl)-6-methylpyrimidine-4-carboxamide
SMILESCc1cc(C(=O)NCc2ccco2)nc(Nc2ccc(C)c(C)c2)n1
InChIInChI=1S/C19H20N4O2/c1-12-6-7-15(9-13(12)2)22-19-21-14(3)10-17(23-19)18(24)20-11-16-5-4-8-25-16/h4-10H,11H2,1-3H3,(H,20,24)(H,21,22,23)
InChIKeyLUFCPNHVNNCRMW-UHFFFAOYSA-N
MW336.40 g/mol
LogP3.67
Rot. Bonds5

About 2-(3,4-dimethylanilino)-N-(furan-2-ylmethyl)-6-methylpyrimidine-4-carboxamide

2-(3,4-dimethylanilino)-N-(furan-2-ylmethyl)-6-methylpyrimidine-4-carboxamide (PubChem CID 109326984) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is 2-(3,4-dimethylanilino)-N-(furan-2-ylmethyl)-6-methylpyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-(3,4-dimethylanilino)-N-(furan-2-ylmethyl)-6-methylpyrimidine-4-carboxamide
PubChem CID109326984
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC Name2-(3,4-dimethylanilino)-N-(furan-2-ylmethyl)-6-methylpyrimidine-4-carboxamide
SMILESCc1cc(C(=O)NCc2ccco2)nc(Nc2ccc(C)c(C)c2)n1
InChIInChI=1S/C19H20N4O2/c1-12-6-7-15(9-13(12)2)22-19-21-14(3)10-17(23-19)18(24)20-11-16-5-4-8-25-16/h4-10H,11H2,1-3H3,(H,20,24)(H,21,22,23)
InChIKeyLUFCPNHVNNCRMW-UHFFFAOYSA-N
XLogP3.67
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-(3,4-dimethylanilino)-N-(furan-2-ylmethyl)-6-methylpyrimidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-ethylanilino)-N-(furan-2-ylmethyl)-6-methylpyrimidine-4-carboxamide
CID 109326989
2-(4-tert-butylanilino)-N-(furan-2-ylmethyl)-6-methylpyrimidine-4-carboxamide
CID 109326998
2-(5-chloro-2-methylanilino)-N-(furan-2-ylmethyl)-6-methylpyrimidine-4-carboxamide
CID 109327005
N-(furan-2-ylmethyl)-2-(2-methoxyanilino)-6-methylpyrimidine-4-carboxamide
CID 109327013
N-(furan-2-ylmethyl)-6-methyl-2-(propan-2-ylamino)pyrimidine-4-carboxamide
CID 109319274
2-(2-chloro-4,6-dimethylanilino)-N-(furan-2-ylmethyl)-6-methylpyrimidine-4-carboxamide
CID 109327009
5-(3,4-dimethylanilino)-N-(furan-2-ylmethyl)pyrazine-2-carboxamide
CID 109279370
2-(3,4-dimethylanilino)-N-(2-methoxyethyl)-6-methylpyrimidine-4-carboxamide
CID 109323755
2-(cyclopentylamino)-N-(furan-2-ylmethyl)-6-methylpyrimidine-4-carboxamide
CID 109321927
2-(3,4-dimethylanilino)-N-(furan-2-ylmethyl)quinoline-4-carboxamide
CID 5074064
2-(furan-2-ylmethylamino)-6-methyl-N-(3-phenylpropyl)pyrimidine-4-carboxamide
CID 109326812
2-(furan-2-ylmethylamino)-6-methyl-N-propan-2-ylpyrimidine-4-carboxamide
CID 109319469

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylanilino)-N-(furan-2-ylmethyl)-6-methylpyrimidine-4-carboxamide?
The IUPAC name of 2-(3,4-dimethylanilino)-N-(furan-2-ylmethyl)-6-methylpyrimidine-4-carboxamide (CID 109326984) is 2-(3,4-dimethylanilino)-N-(furan-2-ylmethyl)-6-methylpyrimidine-4-carboxamide.
What is the SMILES notation for 2-(3,4-dimethylanilino)-N-(furan-2-ylmethyl)-6-methylpyrimidine-4-carboxamide?
The canonical SMILES for 2-(3,4-dimethylanilino)-N-(furan-2-ylmethyl)-6-methylpyrimidine-4-carboxamide is Cc1cc(C(=O)NCc2ccco2)nc(Nc2ccc(C)c(C)c2)n1.
What is the InChIKey of 2-(3,4-dimethylanilino)-N-(furan-2-ylmethyl)-6-methylpyrimidine-4-carboxamide?
The InChIKey is LUFCPNHVNNCRMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-12-6-7-15(9-13(12)2)22-19-21-14(3)10-17(23-19)18(24)20-11-16-5-4-8-25-16/h4-10H,11H2,1-3H3,(H,20,24)(H,21,22,23).
What are the key properties of 2-(3,4-dimethylanilino)-N-(furan-2-ylmethyl)-6-methylpyrimidine-4-carboxamide?
2-(3,4-dimethylanilino)-N-(furan-2-ylmethyl)-6-methylpyrimidine-4-carboxamide has a molecular weight of 336.40 g/mol, XLogP of 3.67, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylanilino)-N-(furan-2-ylmethyl)-6-methylpyrimidine-4-carboxamide is sourced from PubChem (CID 109326984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).