N-(3-methoxypropyl)-N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide

C16H25N3O3 — CID 56901170

IUPACN-(3-methoxypropyl)-N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide
SMILESCOCCCN(C(=O)c1ccc(=O)[nH]c1)C1CCN(C)CC1
InChIInChI=1S/C16H25N3O3/c1-18-9-6-14(7-10-18)19(8-3-11-22-2)16(21)13-4-5-15(20)17-12-13/h4-5,12,14H,3,6-11H2,1-2H3,(H,17,20)
InChIKeyQICASRQUHJLVIQ-UHFFFAOYSA-N
MW307.39 g/mol
LogP0.95
Rot. Bonds6

About N-(3-methoxypropyl)-N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide

N-(3-methoxypropyl)-N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 56901170) has the molecular formula C16H25N3O3 and a molecular weight of 307.39 g/mol. Its IUPAC name is N-(3-methoxypropyl)-N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-methoxypropyl)-N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide
PubChem CID56901170
Molecular FormulaC16H25N3O3
Molecular Weight307.39 g/mol
Exact Mass307.19
IUPAC NameN-(3-methoxypropyl)-N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide
SMILESCOCCCN(C(=O)c1ccc(=O)[nH]c1)C1CCN(C)CC1
InChIInChI=1S/C16H25N3O3/c1-18-9-6-14(7-10-18)19(8-3-11-22-2)16(21)13-4-5-15(20)17-12-13/h4-5,12,14H,3,6-11H2,1-2H3,(H,17,20)
InChIKeyQICASRQUHJLVIQ-UHFFFAOYSA-N
XLogP0.95
TPSA65.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.39
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(4-Aminopiperidin-1-yl)(6-hydroxypyridin-3-yl)methanone
CID 43556202
N-({1-[(2E)-2-methylpent-2-en-1-yl]piperidin-4-yl}methyl)-6-oxo-1,6-dihydropyridine-3-carboxamide
CID 56710306
ethyl 4-[(6-oxo-1H-pyridine-3-carbonyl)amino]piperidine-1-carboxylate
CID 28826314
Ethyl 4-{[(6-ethyl-1,5-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)carbonyl]amino}piperidine-1-carboxylate
CID 74235090
1-methyl-N-(3-morpholin-4-ylpropyl)-6-oxo-1,6-dihydropyridine-3-carboxamide
CID 74239871
1-methyl-N-(1-methylpiperidin-3-yl)-6-oxopyridine-3-carboxamide
CID 121558710
(2Z,3Z)-4-amino-2-(aminomethylidene)-1-[(4S)-3-fluoro-4-methoxypiperidin-1-yl]hepta-3,6-dien-1-one
CID 139353830
N-(1-(1-(L-alanyl)piperidin-4-yl)ethyl)-6-hydroxynicotinamide
CID 132228029
1-methyl-6-oxo-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]pyridine-3-carboxamide
CID 146121806
N-[(3S,4R)-3-fluoro-1-propan-2-ylpiperidin-4-yl]-2-methyl-1-oxo-7H-cyclopenta[c]pyridine-4-carboxamide
CID 159731204
Ethyl 4-{1-[(6-oxo-1,6-dihydro-3-pyridinyl)carbonyl]-3-piperidinyl}-1-piperazinecarboxylate
CID 56899306
5-(piperidine-1-carbonyl)-1H-pyridin-2-one
CID 9813114

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(3-methoxypropyl)-N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide (CID 56901170) is N-(3-methoxypropyl)-N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(3-methoxypropyl)-N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(3-methoxypropyl)-N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide is COCCCN(C(=O)c1ccc(=O)[nH]c1)C1CCN(C)CC1.
What is the InChIKey of N-(3-methoxypropyl)-N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is QICASRQUHJLVIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O3/c1-18-9-6-14(7-10-18)19(8-3-11-22-2)16(21)13-4-5-15(20)17-12-13/h4-5,12,14H,3,6-11H2,1-2H3,(H,17,20).
What are the key properties of N-(3-methoxypropyl)-N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide?
N-(3-methoxypropyl)-N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 307.39 g/mol, XLogP of 0.95, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-N-(1-methylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 56901170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).