4-N-(2-methylpropyl)-2-N-propylpyridine-2,4-dicarboxamide

C14H21N3O2 — CID 109077815

IUPAC4-N-(2-methylpropyl)-2-N-propylpyridine-2,4-dicarboxamide
SMILESCCCNC(=O)c1cc(C(=O)NCC(C)C)ccn1
InChIInChI=1S/C14H21N3O2/c1-4-6-16-14(19)12-8-11(5-7-15-12)13(18)17-9-10(2)3/h5,7-8,10H,4,6,9H2,1-3H3,(H,16,19)(H,17,18)
InChIKeyWHARUFFOVKCPNN-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.61
Rot. Bonds6

About 4-N-(2-methylpropyl)-2-N-propylpyridine-2,4-dicarboxamide

4-N-(2-methylpropyl)-2-N-propylpyridine-2,4-dicarboxamide (PubChem CID 109077815) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 4-N-(2-methylpropyl)-2-N-propylpyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name4-N-(2-methylpropyl)-2-N-propylpyridine-2,4-dicarboxamide
PubChem CID109077815
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name4-N-(2-methylpropyl)-2-N-propylpyridine-2,4-dicarboxamide
SMILESCCCNC(=O)c1cc(C(=O)NCC(C)C)ccn1
InChIInChI=1S/C14H21N3O2/c1-4-6-16-14(19)12-8-11(5-7-15-12)13(18)17-9-10(2)3/h5,7-8,10H,4,6,9H2,1-3H3,(H,16,19)(H,17,18)
InChIKeyWHARUFFOVKCPNN-UHFFFAOYSA-N
XLogP1.61
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-N-(2-methylpropyl)-2-N-(3-phenylpropyl)pyridine-2,4-dicarboxamide
CID 109079626
4-N-butyl-4-N-methyl-2-N-(2-methylpropyl)pyridine-2,4-dicarboxamide
CID 109079822
2-N-[2-(4-fluorophenyl)ethyl]-4-N-propylpyridine-2,4-dicarboxamide
CID 109077658
N-propyl-2-[4-(propylcarbamoyl)-2-pyridinyl]pyridine-4-carboxamide
CID 57050532
2-(butylamino)-N-(2-methylpropyl)pyridine-4-carboxamide
CID 109165522
2-N-[(4-methoxyphenyl)methyl]-4-N-propylpyridine-2,4-dicarboxamide
CID 109077649
4-N-(4-bromophenyl)-2-N-propylpyridine-2,4-dicarboxamide
CID 109077938
4-N-(4-ethylphenyl)-2-N-propylpyridine-2,4-dicarboxamide
CID 109077915
4-N-(3-bromo-4-methylphenyl)-2-N-(2-methylpropyl)pyridine-2,4-dicarboxamide
CID 109079869
2-N-butyl-4-N-(2-methoxyethyl)pyridine-2,4-dicarboxamide
CID 109079379
2-N-butyl-4-N-(3-methoxypropyl)pyridine-2,4-dicarboxamide
CID 109079380
2-N-(3-acetamidophenyl)-4-N-(2-methylpropyl)pyridine-2,4-dicarboxamide
CID 109079698

Frequently Asked Questions

What is the IUPAC name of 4-N-(2-methylpropyl)-2-N-propylpyridine-2,4-dicarboxamide?
The IUPAC name of 4-N-(2-methylpropyl)-2-N-propylpyridine-2,4-dicarboxamide (CID 109077815) is 4-N-(2-methylpropyl)-2-N-propylpyridine-2,4-dicarboxamide.
What is the SMILES notation for 4-N-(2-methylpropyl)-2-N-propylpyridine-2,4-dicarboxamide?
The canonical SMILES for 4-N-(2-methylpropyl)-2-N-propylpyridine-2,4-dicarboxamide is CCCNC(=O)c1cc(C(=O)NCC(C)C)ccn1.
What is the InChIKey of 4-N-(2-methylpropyl)-2-N-propylpyridine-2,4-dicarboxamide?
The InChIKey is WHARUFFOVKCPNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-4-6-16-14(19)12-8-11(5-7-15-12)13(18)17-9-10(2)3/h5,7-8,10H,4,6,9H2,1-3H3,(H,16,19)(H,17,18).
What are the key properties of 4-N-(2-methylpropyl)-2-N-propylpyridine-2,4-dicarboxamide?
4-N-(2-methylpropyl)-2-N-propylpyridine-2,4-dicarboxamide has a molecular weight of 263.34 g/mol, XLogP of 1.61, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(2-methylpropyl)-2-N-propylpyridine-2,4-dicarboxamide is sourced from PubChem (CID 109077815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).