1-methyl-N-[10-[(1-methyl-2H-pyridine-3-carbonyl)amino]decyl]-2H-pyridine-3-carboxamide

C24H38N4O2 — CID 67923287

IUPAC1-methyl-N-[10-[(1-methyl-2H-pyridine-3-carbonyl)amino]decyl]-2H-pyridine-3-carboxamide
SMILESCN1C=CC=C(C(=O)NCCCCCCCCCCNC(=O)C2=CC=CN(C)C2)C1
InChIInChI=1S/C24H38N4O2/c1-27-17-11-13-21(19-27)23(29)25-15-9-7-5-3-4-6-8-10-16-26-24(30)22-14-12-18-28(2)20-22/h11-14,17-18H,3-10,15-16,19-20H2,1-2H3,(H,25,29)(H,26,30)
InChIKeyVTUZUTOWXBHWIU-UHFFFAOYSA-N
MW414.59 g/mol
LogP3.11
Rot. Bonds13

About 1-methyl-N-[10-[(1-methyl-2H-pyridine-3-carbonyl)amino]decyl]-2H-pyridine-3-carboxamide

1-methyl-N-[10-[(1-methyl-2H-pyridine-3-carbonyl)amino]decyl]-2H-pyridine-3-carboxamide (PubChem CID 67923287) has the molecular formula C24H38N4O2 and a molecular weight of 414.59 g/mol. Its IUPAC name is 1-methyl-N-[10-[(1-methyl-2H-pyridine-3-carbonyl)amino]decyl]-2H-pyridine-3-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[10-[(1-methyl-2H-pyridine-3-carbonyl)amino]decyl]-2H-pyridine-3-carboxamide
PubChem CID67923287
Molecular FormulaC24H38N4O2
Molecular Weight414.59 g/mol
Exact Mass414.30
IUPAC Name1-methyl-N-[10-[(1-methyl-2H-pyridine-3-carbonyl)amino]decyl]-2H-pyridine-3-carboxamide
SMILESCN1C=CC=C(C(=O)NCCCCCCCCCCNC(=O)C2=CC=CN(C)C2)C1
InChIInChI=1S/C24H38N4O2/c1-27-17-11-13-21(19-27)23(29)25-15-9-7-5-3-4-6-8-10-16-26-24(30)22-14-12-18-28(2)20-22/h11-14,17-18H,3-10,15-16,19-20H2,1-2H3,(H,25,29)(H,26,30)
InChIKeyVTUZUTOWXBHWIU-UHFFFAOYSA-N
XLogP3.11
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.59
LogP ≤ 53.11
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

N-(6-hydroxyhexyl)cyclopenta-1,3-diene-1-carboxamide
CID 102277327
propyl 1-methyl-2H-pyridine-3-carboxylate;hydrochloride
CID 67461618
N-butyl-1,2-dihydropyridine-3-carboxamide
CID 144846174
1-(9,10-dichlorooctadecoxymethyl)-N-ethyl-2H-pyridine-3-carboxamide
CID 54484374
3-(cyclopenta-1,3-diene-1-carbonylamino)propanoic acid
CID 59440444
N-(5-bromopentyl)-1-methylpyrazole-4-carboxamide
CID 107321851
N-(5-aminopentyl)-1,3-dimethylpyrazole-4-carboxamide
CID 102801078
N-(7-aminoheptyl)-1-methylimidazole-2-carboxamide
CID 101260235
N-[5-(4-ethylpiperazin-1-yl)pentyl]-2-fluorobenzamide
CID 110444095
4-chloro-N-[8-[(4-chlorobenzoyl)amino]octyl]benzamide
CID 3606775
1-butyl-2H-pyridine-3-carboxylic acid;hydrobromide
CID 172823274
N-(5-hydroxypentyl)-1-methyl-2,3-dihydroindole-5-carboxamide
CID 110485516

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[10-[(1-methyl-2H-pyridine-3-carbonyl)amino]decyl]-2H-pyridine-3-carboxamide?
The IUPAC name of 1-methyl-N-[10-[(1-methyl-2H-pyridine-3-carbonyl)amino]decyl]-2H-pyridine-3-carboxamide (CID 67923287) is 1-methyl-N-[10-[(1-methyl-2H-pyridine-3-carbonyl)amino]decyl]-2H-pyridine-3-carboxamide.
What is the SMILES notation for 1-methyl-N-[10-[(1-methyl-2H-pyridine-3-carbonyl)amino]decyl]-2H-pyridine-3-carboxamide?
The canonical SMILES for 1-methyl-N-[10-[(1-methyl-2H-pyridine-3-carbonyl)amino]decyl]-2H-pyridine-3-carboxamide is CN1C=CC=C(C(=O)NCCCCCCCCCCNC(=O)C2=CC=CN(C)C2)C1.
What is the InChIKey of 1-methyl-N-[10-[(1-methyl-2H-pyridine-3-carbonyl)amino]decyl]-2H-pyridine-3-carboxamide?
The InChIKey is VTUZUTOWXBHWIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H38N4O2/c1-27-17-11-13-21(19-27)23(29)25-15-9-7-5-3-4-6-8-10-16-26-24(30)22-14-12-18-28(2)20-22/h11-14,17-18H,3-10,15-16,19-20H2,1-2H3,(H,25,29)(H,26,30).
What are the key properties of 1-methyl-N-[10-[(1-methyl-2H-pyridine-3-carbonyl)amino]decyl]-2H-pyridine-3-carboxamide?
1-methyl-N-[10-[(1-methyl-2H-pyridine-3-carbonyl)amino]decyl]-2H-pyridine-3-carboxamide has a molecular weight of 414.59 g/mol, XLogP of 3.11, 13 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[10-[(1-methyl-2H-pyridine-3-carbonyl)amino]decyl]-2H-pyridine-3-carboxamide is sourced from PubChem (CID 67923287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).