3-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide

C13H15N3O2 — CID 113447596

IUPAC3-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide
SMILESCc1ccc(CN(C)C(=O)c2ncccc2N)o1
InChIInChI=1S/C13H15N3O2/c1-9-5-6-10(18-9)8-16(2)13(17)12-11(14)4-3-7-15-12/h3-7H,8,14H2,1-2H3
InChIKeyCQSPDZSXEFILHW-UHFFFAOYSA-N
MW245.28 g/mol
LogP1.84
Rot. Bonds3

About 3-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide

3-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide (PubChem CID 113447596) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is 3-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide
PubChem CID113447596
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC Name3-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide
SMILESCc1ccc(CN(C)C(=O)c2ncccc2N)o1
InChIInChI=1S/C13H15N3O2/c1-9-5-6-10(18-9)8-16(2)13(17)12-11(14)4-3-7-15-12/h3-7H,8,14H2,1-2H3
InChIKeyCQSPDZSXEFILHW-UHFFFAOYSA-N
XLogP1.84
TPSA72.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-methyl-N-(thiophen-2-ylmethyl)pyridine-2-carboxamide
CID 104741052
4-amino-N,1-dimethyl-N-[(5-methylfuran-2-yl)methyl]pyrazole-3-carboxamide
CID 65355272
2-[(3-aminopyridine-2-carbonyl)-methylamino]acetic acid
CID 112704117
3-amino-N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pyridine-2-carboxamide
CID 104742351
3-amino-N-[(2-fluorophenyl)methyl]-N-methylpyridine-2-carboxamide
CID 104741078
2-[[methyl-[(5-methylfuran-2-yl)methyl]amino]methyl]pyridin-3-amine
CID 113447401
3-amino-N-hydroxy-N-methylpyridine-2-carboxamide
CID 130884472
3-amino-N-[(3-chlorophenyl)methyl]-N-methylpyridine-2-carboxamide
CID 104741524
3-hydroxy-N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 82786543
3-(2-aminophenoxy)-N-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 61093438
3-amino-N-methyl-N-(oxan-4-ylmethyl)pyridine-2-carboxamide
CID 104742327
2-N,5-N-dimethyl-2-N,5-N-bis[(5-methylfuran-2-yl)methyl]thiophene-2,5-dicarboxamide
CID 56809035

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide (CID 113447596) is 3-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide is Cc1ccc(CN(C)C(=O)c2ncccc2N)o1.
What is the InChIKey of 3-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide?
The InChIKey is CQSPDZSXEFILHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-9-5-6-10(18-9)8-16(2)13(17)12-11(14)4-3-7-15-12/h3-7H,8,14H2,1-2H3.
What are the key properties of 3-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide?
3-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide has a molecular weight of 245.28 g/mol, XLogP of 1.84, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide is sourced from PubChem (CID 113447596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).