N-(3-methoxypropyl)-5-(3-methoxypropylamino)pyridine-2-carboxamide

C14H23N3O3 — CID 109184195

IUPACN-(3-methoxypropyl)-5-(3-methoxypropylamino)pyridine-2-carboxamide
SMILESCOCCCNC(=O)c1ccc(NCCCOC)cn1
InChIInChI=1S/C14H23N3O3/c1-19-9-3-7-15-12-5-6-13(17-11-12)14(18)16-8-4-10-20-2/h5-6,11,15H,3-4,7-10H2,1-2H3,(H,16,18)
InChIKeyMCMMQQHJQPBCNY-UHFFFAOYSA-N
MW281.36 g/mol
LogP1.30
Rot. Bonds10

About N-(3-methoxypropyl)-5-(3-methoxypropylamino)pyridine-2-carboxamide

N-(3-methoxypropyl)-5-(3-methoxypropylamino)pyridine-2-carboxamide (PubChem CID 109184195) has the molecular formula C14H23N3O3 and a molecular weight of 281.36 g/mol. Its IUPAC name is N-(3-methoxypropyl)-5-(3-methoxypropylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-methoxypropyl)-5-(3-methoxypropylamino)pyridine-2-carboxamide
PubChem CID109184195
Molecular FormulaC14H23N3O3
Molecular Weight281.36 g/mol
Exact Mass281.17
IUPAC NameN-(3-methoxypropyl)-5-(3-methoxypropylamino)pyridine-2-carboxamide
SMILESCOCCCNC(=O)c1ccc(NCCCOC)cn1
InChIInChI=1S/C14H23N3O3/c1-19-9-3-7-15-12-5-6-13(17-11-12)14(18)16-8-4-10-20-2/h5-6,11,15H,3-4,7-10H2,1-2H3,(H,16,18)
InChIKeyMCMMQQHJQPBCNY-UHFFFAOYSA-N
XLogP1.30
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

5-[2-(dimethylamino)ethylamino]-N-(3-methoxypropyl)pyridine-2-carboxamide
CID 109184198
N-(3-methoxypropyl)-5-(prop-2-enylamino)pyridine-2-carboxamide
CID 109180434
5-(4-bromoanilino)-N-(3-methoxypropyl)pyridine-2-carboxamide
CID 109184307
N-(3-methoxypropyl)-5-[(2-methylphenyl)methylamino]pyridine-2-carboxamide
CID 109184207
5-(cyclohexylamino)-N-(3-methoxypropyl)pyridine-2-carboxamide
CID 109183067
5-(2-methoxyethylamino)-N-(3-phenylpropyl)pyridine-2-carboxamide
CID 109184071
N-(2-methoxyethyl)-5-(3-methylbutylamino)pyridine-2-carboxamide
CID 109183892
5-(3-methoxypropylamino)-N-(4-phenoxyphenyl)pyridine-2-carboxamide
CID 109184521
5-(3-chloro-4-methoxyanilino)-N-(3-methoxypropyl)pyridine-2-carboxamide
CID 109184305
5-(3-bromoanilino)-N-(3-methoxypropyl)pyridine-2-carboxamide
CID 109184344
N-(5-chloro-2-methylphenyl)-5-(3-methoxypropylamino)pyridine-2-carboxamide
CID 109184481
[5-(3-methoxypropylamino)-2-pyridinyl]-piperidin-1-ylmethanone
CID 109182537

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-5-(3-methoxypropylamino)pyridine-2-carboxamide?
The IUPAC name of N-(3-methoxypropyl)-5-(3-methoxypropylamino)pyridine-2-carboxamide (CID 109184195) is N-(3-methoxypropyl)-5-(3-methoxypropylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(3-methoxypropyl)-5-(3-methoxypropylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(3-methoxypropyl)-5-(3-methoxypropylamino)pyridine-2-carboxamide is COCCCNC(=O)c1ccc(NCCCOC)cn1.
What is the InChIKey of N-(3-methoxypropyl)-5-(3-methoxypropylamino)pyridine-2-carboxamide?
The InChIKey is MCMMQQHJQPBCNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3/c1-19-9-3-7-15-12-5-6-13(17-11-12)14(18)16-8-4-10-20-2/h5-6,11,15H,3-4,7-10H2,1-2H3,(H,16,18).
What are the key properties of N-(3-methoxypropyl)-5-(3-methoxypropylamino)pyridine-2-carboxamide?
N-(3-methoxypropyl)-5-(3-methoxypropylamino)pyridine-2-carboxamide has a molecular weight of 281.36 g/mol, XLogP of 1.30, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-5-(3-methoxypropylamino)pyridine-2-carboxamide is sourced from PubChem (CID 109184195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).