2-[pentanoyl(piperidin-4-yl)amino]-1,2-dihydropyridine-6-carboxamide

C16H26N4O2 — CID 173104506

IUPAC2-[pentanoyl(piperidin-4-yl)amino]-1,2-dihydropyridine-6-carboxamide
SMILESCCCCC(=O)N(C1CCNCC1)C1C=CC=C(C(N)=O)N1
InChIInChI=1S/C16H26N4O2/c1-2-3-7-15(21)20(12-8-10-18-11-9-12)14-6-4-5-13(19-14)16(17)22/h4-6,12,14,18-19H,2-3,7-11H2,1H3,(H2,17,22)
InChIKeyQYGMPMLKJLCDTM-UHFFFAOYSA-N
MW306.41 g/mol
LogP0.61
Rot. Bonds6

About 2-[pentanoyl(piperidin-4-yl)amino]-1,2-dihydropyridine-6-carboxamide

2-[pentanoyl(piperidin-4-yl)amino]-1,2-dihydropyridine-6-carboxamide (PubChem CID 173104506) has the molecular formula C16H26N4O2 and a molecular weight of 306.41 g/mol. Its IUPAC name is 2-[pentanoyl(piperidin-4-yl)amino]-1,2-dihydropyridine-6-carboxamide.

Molecular Properties

Compound Name2-[pentanoyl(piperidin-4-yl)amino]-1,2-dihydropyridine-6-carboxamide
PubChem CID173104506
Molecular FormulaC16H26N4O2
Molecular Weight306.41 g/mol
Exact Mass306.21
IUPAC Name2-[pentanoyl(piperidin-4-yl)amino]-1,2-dihydropyridine-6-carboxamide
SMILESCCCCC(=O)N(C1CCNCC1)C1C=CC=C(C(N)=O)N1
InChIInChI=1S/C16H26N4O2/c1-2-3-7-15(21)20(12-8-10-18-11-9-12)14-6-4-5-13(19-14)16(17)22/h4-6,12,14,18-19H,2-3,7-11H2,1H3,(H2,17,22)
InChIKeyQYGMPMLKJLCDTM-UHFFFAOYSA-N
XLogP0.61
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 50.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[pentanoyl(piperidin-4-yl)amino]-1,2-dihydropyridine-6-carboxamide?
The IUPAC name of 2-[pentanoyl(piperidin-4-yl)amino]-1,2-dihydropyridine-6-carboxamide (CID 173104506) is 2-[pentanoyl(piperidin-4-yl)amino]-1,2-dihydropyridine-6-carboxamide.
What is the SMILES notation for 2-[pentanoyl(piperidin-4-yl)amino]-1,2-dihydropyridine-6-carboxamide?
The canonical SMILES for 2-[pentanoyl(piperidin-4-yl)amino]-1,2-dihydropyridine-6-carboxamide is CCCCC(=O)N(C1CCNCC1)C1C=CC=C(C(N)=O)N1.
What is the InChIKey of 2-[pentanoyl(piperidin-4-yl)amino]-1,2-dihydropyridine-6-carboxamide?
The InChIKey is QYGMPMLKJLCDTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O2/c1-2-3-7-15(21)20(12-8-10-18-11-9-12)14-6-4-5-13(19-14)16(17)22/h4-6,12,14,18-19H,2-3,7-11H2,1H3,(H2,17,22).
What are the key properties of 2-[pentanoyl(piperidin-4-yl)amino]-1,2-dihydropyridine-6-carboxamide?
2-[pentanoyl(piperidin-4-yl)amino]-1,2-dihydropyridine-6-carboxamide has a molecular weight of 306.41 g/mol, XLogP of 0.61, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[pentanoyl(piperidin-4-yl)amino]-1,2-dihydropyridine-6-carboxamide is sourced from PubChem (CID 173104506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).