3-propylpyridine-2,4-dicarboxamide

C10H13N3O2 — CID 141047751

IUPAC3-propylpyridine-2,4-dicarboxamide
SMILESCCCc1c(C(N)=O)ccnc1C(N)=O
InChIInChI=1S/C10H13N3O2/c1-2-3-6-7(9(11)14)4-5-13-8(6)10(12)15/h4-5H,2-3H2,1H3,(H2,11,14)(H2,12,15)
InChIKeyKWCUPTVZVMQCTK-UHFFFAOYSA-N
MW207.23 g/mol
LogP0.23
Rot. Bonds4

About 3-propylpyridine-2,4-dicarboxamide

3-propylpyridine-2,4-dicarboxamide (PubChem CID 141047751) has the molecular formula C10H13N3O2 and a molecular weight of 207.23 g/mol. Its IUPAC name is 3-propylpyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name3-propylpyridine-2,4-dicarboxamide
PubChem CID141047751
Molecular FormulaC10H13N3O2
Molecular Weight207.23 g/mol
Exact Mass207.10
IUPAC Name3-propylpyridine-2,4-dicarboxamide
SMILESCCCc1c(C(N)=O)ccnc1C(N)=O
InChIInChI=1S/C10H13N3O2/c1-2-3-6-7(9(11)14)4-5-13-8(6)10(12)15/h4-5H,2-3H2,1H3,(H2,11,14)(H2,12,15)
InChIKeyKWCUPTVZVMQCTK-UHFFFAOYSA-N
XLogP0.23
TPSA99.07 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 50.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-dimethyl-2-propylbenzamide
CID 154390636
3-bromo-2-propylbenzamide
CID 69458474
3-chloro-4-methyl-2-propylbenzamide
CID 141280601
2-propyl-5-(1,3-thiazol-2-yl)benzene-1,3-dicarboxamide
CID 21087167
3-acetyl-4-(ethylamino)pyridine-2-carboxamide
CID 169256921
2-butyl-3-[2-(2-chloro-4-pyridinyl)-2-oxoethyl]pyridine-4-carboxamide
CID 174595712
5-propyl-1,2-oxazole-4-carboxamide
CID 67871556
3,4-dimethylpyridine-2-carboxamide;hydrochloride
CID 118095739
4-butan-2-ylpyridine-2,3-dicarboxamide
CID 67796914
3-acetyl-4-aminopyridine-2-carboxamide
CID 139348420
2-propylpyrazolo[4,3-c]pyridine-4-carboxamide
CID 142768221
3-[(2S)-butan-2-yl]-4-chloropyridine-2-carboxamide
CID 155713883

Frequently Asked Questions

What is the IUPAC name of 3-propylpyridine-2,4-dicarboxamide?
The IUPAC name of 3-propylpyridine-2,4-dicarboxamide (CID 141047751) is 3-propylpyridine-2,4-dicarboxamide.
What is the SMILES notation for 3-propylpyridine-2,4-dicarboxamide?
The canonical SMILES for 3-propylpyridine-2,4-dicarboxamide is CCCc1c(C(N)=O)ccnc1C(N)=O.
What is the InChIKey of 3-propylpyridine-2,4-dicarboxamide?
The InChIKey is KWCUPTVZVMQCTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2/c1-2-3-6-7(9(11)14)4-5-13-8(6)10(12)15/h4-5H,2-3H2,1H3,(H2,11,14)(H2,12,15).
What are the key properties of 3-propylpyridine-2,4-dicarboxamide?
3-propylpyridine-2,4-dicarboxamide has a molecular weight of 207.23 g/mol, XLogP of 0.23, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propylpyridine-2,4-dicarboxamide is sourced from PubChem (CID 141047751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).