N-ethyl-4-[5-hydroxypentyl(methyl)amino]pyridine-2-carboxamide

C14H23N3O2 — CID 107203439

IUPACN-ethyl-4-[5-hydroxypentyl(methyl)amino]pyridine-2-carboxamide
SMILESCCNC(=O)c1cc(N(C)CCCCCO)ccn1
InChIInChI=1S/C14H23N3O2/c1-3-15-14(19)13-11-12(7-8-16-13)17(2)9-5-4-6-10-18/h7-8,11,18H,3-6,9-10H2,1-2H3,(H,15,19)
InChIKeyROICFAXJSNORJN-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.43
Rot. Bonds8

About N-ethyl-4-[5-hydroxypentyl(methyl)amino]pyridine-2-carboxamide

N-ethyl-4-[5-hydroxypentyl(methyl)amino]pyridine-2-carboxamide (PubChem CID 107203439) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-ethyl-4-[5-hydroxypentyl(methyl)amino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-[5-hydroxypentyl(methyl)amino]pyridine-2-carboxamide
PubChem CID107203439
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC NameN-ethyl-4-[5-hydroxypentyl(methyl)amino]pyridine-2-carboxamide
SMILESCCNC(=O)c1cc(N(C)CCCCCO)ccn1
InChIInChI=1S/C14H23N3O2/c1-3-15-14(19)13-11-12(7-8-16-13)17(2)9-5-4-6-10-18/h7-8,11,18H,3-6,9-10H2,1-2H3,(H,15,19)
InChIKeyROICFAXJSNORJN-UHFFFAOYSA-N
XLogP1.43
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.43
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

4-[butyl(methyl)amino]-N-pentylpyridine-2-carboxamide
CID 109217497
methyl 2-[[2-(ethylcarbamoyl)-4-pyridinyl]-methylamino]acetate
CID 62006034
5-[[2-(ethylamino)-4-pyridinyl]-methylamino]pentan-1-ol
CID 107207562
4-[(4-aminophenyl)methyl-methylamino]-N-ethylpyridine-2-carboxamide
CID 60877624
4-[butyl(methyl)amino]-N-[(4-fluorophenyl)methyl]pyridine-2-carboxamide
CID 109211411
N-butyl-4-[butyl(methyl)amino]-N-methylpyridine-2-carboxamide
CID 109217701
4-[3-aminopropyl(propan-2-yl)amino]-N-ethylpyridine-2-carboxamide
CID 43517813
methyl 4-[methyl-[2-(methylcarbamoyl)-4-pyridinyl]amino]butanoate
CID 62005376
4-[[2-(ethylcarbamoyl)-4-pyridinyl]-propan-2-ylamino]butanoic acid
CID 60839856
4-[butyl(methyl)amino]pyridine-2-carboxamide
CID 133313214
5-[(2-methoxy-4-pyridinyl)-methylamino]pentan-1-ol
CID 107203261
2-[ethyl-[2-(ethylcarbamoyl)-4-pyridinyl]amino]-2-methylpropanoic acid
CID 62818215

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[5-hydroxypentyl(methyl)amino]pyridine-2-carboxamide?
The IUPAC name of N-ethyl-4-[5-hydroxypentyl(methyl)amino]pyridine-2-carboxamide (CID 107203439) is N-ethyl-4-[5-hydroxypentyl(methyl)amino]pyridine-2-carboxamide.
What is the SMILES notation for N-ethyl-4-[5-hydroxypentyl(methyl)amino]pyridine-2-carboxamide?
The canonical SMILES for N-ethyl-4-[5-hydroxypentyl(methyl)amino]pyridine-2-carboxamide is CCNC(=O)c1cc(N(C)CCCCCO)ccn1.
What is the InChIKey of N-ethyl-4-[5-hydroxypentyl(methyl)amino]pyridine-2-carboxamide?
The InChIKey is ROICFAXJSNORJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-3-15-14(19)13-11-12(7-8-16-13)17(2)9-5-4-6-10-18/h7-8,11,18H,3-6,9-10H2,1-2H3,(H,15,19).
What are the key properties of N-ethyl-4-[5-hydroxypentyl(methyl)amino]pyridine-2-carboxamide?
N-ethyl-4-[5-hydroxypentyl(methyl)amino]pyridine-2-carboxamide has a molecular weight of 265.36 g/mol, XLogP of 1.43, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[5-hydroxypentyl(methyl)amino]pyridine-2-carboxamide is sourced from PubChem (CID 107203439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).