6-N-cyclopentyl-2-N-(3-methoxypropyl)pyridine-2,6-dicarboxamide

C16H23N3O3 — CID 109094939

IUPAC6-N-cyclopentyl-2-N-(3-methoxypropyl)pyridine-2,6-dicarboxamide
SMILESCOCCCNC(=O)c1cccc(C(=O)NC2CCCC2)n1
InChIInChI=1S/C16H23N3O3/c1-22-11-5-10-17-15(20)13-8-4-9-14(19-13)16(21)18-12-6-2-3-7-12/h4,8-9,12H,2-3,5-7,10-11H2,1H3,(H,17,20)(H,18,21)
InChIKeyHQTVFNVHSRKFDM-UHFFFAOYSA-N
MW305.38 g/mol
LogP1.52
Rot. Bonds7

About 6-N-cyclopentyl-2-N-(3-methoxypropyl)pyridine-2,6-dicarboxamide

6-N-cyclopentyl-2-N-(3-methoxypropyl)pyridine-2,6-dicarboxamide (PubChem CID 109094939) has the molecular formula C16H23N3O3 and a molecular weight of 305.38 g/mol. Its IUPAC name is 6-N-cyclopentyl-2-N-(3-methoxypropyl)pyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name6-N-cyclopentyl-2-N-(3-methoxypropyl)pyridine-2,6-dicarboxamide
PubChem CID109094939
Molecular FormulaC16H23N3O3
Molecular Weight305.38 g/mol
Exact Mass305.17
IUPAC Name6-N-cyclopentyl-2-N-(3-methoxypropyl)pyridine-2,6-dicarboxamide
SMILESCOCCCNC(=O)c1cccc(C(=O)NC2CCCC2)n1
InChIInChI=1S/C16H23N3O3/c1-22-11-5-10-17-15(20)13-8-4-9-14(19-13)16(21)18-12-6-2-3-7-12/h4,8-9,12H,2-3,5-7,10-11H2,1H3,(H,17,20)(H,18,21)
InChIKeyHQTVFNVHSRKFDM-UHFFFAOYSA-N
XLogP1.52
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-N-cycloheptyl-2-N-[3-(dimethylamino)propyl]pyridine-2,6-dicarboxamide
CID 109096549
2-N-cycloheptyl-6-N-cyclohexylpyridine-2,6-dicarboxamide
CID 109095319
2-N-cycloheptyl-6-N-cyclopropylpyridine-2,6-dicarboxamide
CID 109093881
N-(3-methoxypropyl)-6-(4-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109095410
6-methoxy-N-(3-methoxypropyl)pyridine-2-carboxamide
CID 84581499
6-N-cyclohexyl-2-N-prop-2-enylpyridine-2,6-dicarboxamide
CID 109094007
6-(cyclohexylamino)-N-(3-methoxypropyl)-2-methylpyrimidine-4-carboxamide
CID 109363776
2-N-cycloheptyl-6-N,6-N-dipropylpyridine-2,6-dicarboxamide
CID 109099249
6-N-[2-(4-methoxyphenyl)ethyl]-2-N-(3-methoxypropyl)pyridine-2,6-dicarboxamide
CID 109095851
5-(cyclohexylamino)-N-(3-methoxypropyl)pyridine-2-carboxamide
CID 109183067
6-N-cyclopropyl-2-N-[(4-methoxyphenyl)methyl]pyridine-2,6-dicarboxamide
CID 109093839
4-(cycloheptylamino)-N-(3-methoxypropyl)pyridine-2-carboxamide
CID 109206087

Frequently Asked Questions

What is the IUPAC name of 6-N-cyclopentyl-2-N-(3-methoxypropyl)pyridine-2,6-dicarboxamide?
The IUPAC name of 6-N-cyclopentyl-2-N-(3-methoxypropyl)pyridine-2,6-dicarboxamide (CID 109094939) is 6-N-cyclopentyl-2-N-(3-methoxypropyl)pyridine-2,6-dicarboxamide.
What is the SMILES notation for 6-N-cyclopentyl-2-N-(3-methoxypropyl)pyridine-2,6-dicarboxamide?
The canonical SMILES for 6-N-cyclopentyl-2-N-(3-methoxypropyl)pyridine-2,6-dicarboxamide is COCCCNC(=O)c1cccc(C(=O)NC2CCCC2)n1.
What is the InChIKey of 6-N-cyclopentyl-2-N-(3-methoxypropyl)pyridine-2,6-dicarboxamide?
The InChIKey is HQTVFNVHSRKFDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O3/c1-22-11-5-10-17-15(20)13-8-4-9-14(19-13)16(21)18-12-6-2-3-7-12/h4,8-9,12H,2-3,5-7,10-11H2,1H3,(H,17,20)(H,18,21).
What are the key properties of 6-N-cyclopentyl-2-N-(3-methoxypropyl)pyridine-2,6-dicarboxamide?
6-N-cyclopentyl-2-N-(3-methoxypropyl)pyridine-2,6-dicarboxamide has a molecular weight of 305.38 g/mol, XLogP of 1.52, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-cyclopentyl-2-N-(3-methoxypropyl)pyridine-2,6-dicarboxamide is sourced from PubChem (CID 109094939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).