N-(3-methoxypropyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide

C14H23N3O2 — CID 105069961

IUPACN-(3-methoxypropyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)N(C)CCCOC
InChIInChI=1S/C14H23N3O2/c1-4-7-16-13-11-15-8-6-12(13)14(18)17(2)9-5-10-19-3/h6,8,11,16H,4-5,7,9-10H2,1-3H3
InChIKeyHDBKWGWXSBDPBZ-UHFFFAOYSA-N
MW265.36 g/mol
LogP2.01
Rot. Bonds8

About N-(3-methoxypropyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide

N-(3-methoxypropyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide (PubChem CID 105069961) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-(3-methoxypropyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(3-methoxypropyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
PubChem CID105069961
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC NameN-(3-methoxypropyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)N(C)CCCOC
InChIInChI=1S/C14H23N3O2/c1-4-7-16-13-11-15-8-6-12(13)14(18)17(2)9-5-10-19-3/h6,8,11,16H,4-5,7,9-10H2,1-3H3
InChIKeyHDBKWGWXSBDPBZ-UHFFFAOYSA-N
XLogP2.01
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 52.01
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

N-(5-hydroxypentyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 107201068
3-(ethylamino)-N-methyl-N-propylpyridine-4-carboxamide
CID 105068562
N-(2-cyanoethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105068056
N-(3-hydroxybutyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105071302
N-[3-(dimethylamino)propyl]-3-(propylamino)pyridine-4-carboxamide
CID 105068347
3-(ethylamino)-N-[2-[2-methoxyethyl(methyl)amino]ethyl]pyridine-4-carboxamide
CID 105069888
N-(cyclopropylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105068880
N-[2-(2-methoxyethylamino)-2-oxoethyl]-3-(propylamino)pyridine-4-carboxamide
CID 105071089
N-methyl-3-(propylamino)-N-pyridin-4-ylpyridine-4-carboxamide
CID 106937266
N-(1H-imidazol-2-ylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105070360
N,N-bis(2-methoxyethyl)-4-(propylamino)pyridine-3-carboxamide
CID 81237784
N-(cyclopentylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105070142

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide?
The IUPAC name of N-(3-methoxypropyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide (CID 105069961) is N-(3-methoxypropyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(3-methoxypropyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(3-methoxypropyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide is CCCNc1cnccc1C(=O)N(C)CCCOC.
What is the InChIKey of N-(3-methoxypropyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide?
The InChIKey is HDBKWGWXSBDPBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-4-7-16-13-11-15-8-6-12(13)14(18)17(2)9-5-10-19-3/h6,8,11,16H,4-5,7,9-10H2,1-3H3.
What are the key properties of N-(3-methoxypropyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide?
N-(3-methoxypropyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide has a molecular weight of 265.36 g/mol, XLogP of 2.01, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 105069961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).