N-[(2-methylphenyl)methyl]-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide

C19H23N3O2 — CID 109185110

IUPACN-[(2-methylphenyl)methyl]-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide
SMILESCc1ccccc1CNC(=O)c1ccc(NCC2CCCO2)cn1
InChIInChI=1S/C19H23N3O2/c1-14-5-2-3-6-15(14)11-22-19(23)18-9-8-16(12-21-18)20-13-17-7-4-10-24-17/h2-3,5-6,8-9,12,17,20H,4,7,10-11,13H2,1H3,(H,22,23)
InChIKeyGGRMMGGJVJQYKD-UHFFFAOYSA-N
MW325.41 g/mol
LogP2.91
Rot. Bonds6

About N-[(2-methylphenyl)methyl]-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide

N-[(2-methylphenyl)methyl]-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide (PubChem CID 109185110) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is N-[(2-methylphenyl)methyl]-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(2-methylphenyl)methyl]-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide
PubChem CID109185110
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC NameN-[(2-methylphenyl)methyl]-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide
SMILESCc1ccccc1CNC(=O)c1ccc(NCC2CCCO2)cn1
InChIInChI=1S/C19H23N3O2/c1-14-5-2-3-6-15(14)11-22-19(23)18-9-8-16(12-21-18)20-13-17-7-4-10-24-17/h2-3,5-6,8-9,12,17,20H,4,7,10-11,13H2,1H3,(H,22,23)
InChIKeyGGRMMGGJVJQYKD-UHFFFAOYSA-N
XLogP2.91
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-chlorophenyl)methyl]-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide
CID 109185117
N-[(2-methylphenyl)methyl]-6-(oxolan-2-ylmethylamino)pyrimidine-4-carboxamide
CID 109343712
5-(oxolan-2-ylmethylamino)-N-phenylpyridine-2-carboxamide
CID 109185172
5-[(2-fluorophenyl)methylamino]-N-(oxolan-2-ylmethyl)pyridine-2-carboxamide
CID 109184938
4-N-[(2-methylphenyl)methyl]-2-N-(oxolan-2-ylmethyl)pyridine-2,4-dicarboxamide
CID 109083260
N-[(4-methoxyphenyl)methyl]-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide
CID 109185120
3-N-[(2-methylphenyl)methyl]-5-N-(oxolan-2-ylmethyl)pyridine-3,5-dicarboxamide
CID 109103889
N-[(3,4-dimethoxyphenyl)methyl]-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide
CID 109185142
N-(2-fluorophenyl)-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide
CID 109185196
N-(2,4-dimethylphenyl)-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide
CID 109185179
5-(oxolan-2-ylmethylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide
CID 109185242
N-[(2-fluorophenyl)methyl]-4-(oxolan-2-ylmethylamino)pyridine-2-carboxamide
CID 109206922

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylphenyl)methyl]-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide?
The IUPAC name of N-[(2-methylphenyl)methyl]-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide (CID 109185110) is N-[(2-methylphenyl)methyl]-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-[(2-methylphenyl)methyl]-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide?
The canonical SMILES for N-[(2-methylphenyl)methyl]-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide is Cc1ccccc1CNC(=O)c1ccc(NCC2CCCO2)cn1.
What is the InChIKey of N-[(2-methylphenyl)methyl]-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide?
The InChIKey is GGRMMGGJVJQYKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-14-5-2-3-6-15(14)11-22-19(23)18-9-8-16(12-21-18)20-13-17-7-4-10-24-17/h2-3,5-6,8-9,12,17,20H,4,7,10-11,13H2,1H3,(H,22,23).
What are the key properties of N-[(2-methylphenyl)methyl]-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide?
N-[(2-methylphenyl)methyl]-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide has a molecular weight of 325.41 g/mol, XLogP of 2.91, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylphenyl)methyl]-5-(oxolan-2-ylmethylamino)pyridine-2-carboxamide is sourced from PubChem (CID 109185110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).