6-methyl-4-propan-2-yl-N-propylpyridine-2-carboxamide

C13H20N2O — CID 142843630

IUPAC6-methyl-4-propan-2-yl-N-propylpyridine-2-carboxamide
SMILESCCCNC(=O)c1cc(C(C)C)cc(C)n1
InChIInChI=1S/C13H20N2O/c1-5-6-14-13(16)12-8-11(9(2)3)7-10(4)15-12/h7-9H,5-6H2,1-4H3,(H,14,16)
InChIKeyCYVAIIRRDISEOZ-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.65
Rot. Bonds4

About 6-methyl-4-propan-2-yl-N-propylpyridine-2-carboxamide

6-methyl-4-propan-2-yl-N-propylpyridine-2-carboxamide (PubChem CID 142843630) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 6-methyl-4-propan-2-yl-N-propylpyridine-2-carboxamide.

Molecular Properties

Compound Name6-methyl-4-propan-2-yl-N-propylpyridine-2-carboxamide
PubChem CID142843630
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name6-methyl-4-propan-2-yl-N-propylpyridine-2-carboxamide
SMILESCCCNC(=O)c1cc(C(C)C)cc(C)n1
InChIInChI=1S/C13H20N2O/c1-5-6-14-13(16)12-8-11(9(2)3)7-10(4)15-12/h7-9H,5-6H2,1-4H3,(H,14,16)
InChIKeyCYVAIIRRDISEOZ-UHFFFAOYSA-N
XLogP2.65
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-propan-2-yl-N-propylpyridine-2-carboxamide?
The IUPAC name of 6-methyl-4-propan-2-yl-N-propylpyridine-2-carboxamide (CID 142843630) is 6-methyl-4-propan-2-yl-N-propylpyridine-2-carboxamide.
What is the SMILES notation for 6-methyl-4-propan-2-yl-N-propylpyridine-2-carboxamide?
The canonical SMILES for 6-methyl-4-propan-2-yl-N-propylpyridine-2-carboxamide is CCCNC(=O)c1cc(C(C)C)cc(C)n1.
What is the InChIKey of 6-methyl-4-propan-2-yl-N-propylpyridine-2-carboxamide?
The InChIKey is CYVAIIRRDISEOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-5-6-14-13(16)12-8-11(9(2)3)7-10(4)15-12/h7-9H,5-6H2,1-4H3,(H,14,16).
What are the key properties of 6-methyl-4-propan-2-yl-N-propylpyridine-2-carboxamide?
6-methyl-4-propan-2-yl-N-propylpyridine-2-carboxamide has a molecular weight of 220.32 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-propan-2-yl-N-propylpyridine-2-carboxamide is sourced from PubChem (CID 142843630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).