N-methyl-2-(methylamino)-N-(1-pyridin-3-ylpropyl)pyridine-3-carboxamide

C16H20N4O — CID 74248524

IUPACN-methyl-2-(methylamino)-N-(1-pyridin-3-ylpropyl)pyridine-3-carboxamide
SMILESCCC(c1cccnc1)N(C)C(=O)c1cccnc1NC
InChIInChI=1S/C16H20N4O/c1-4-14(12-7-5-9-18-11-12)20(3)16(21)13-8-6-10-19-15(13)17-2/h5-11,14H,4H2,1-3H3,(H,17,19)
InChIKeySHNOMOHJYVNFPF-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.74
Rot. Bonds5

About N-methyl-2-(methylamino)-N-(1-pyridin-3-ylpropyl)pyridine-3-carboxamide

N-methyl-2-(methylamino)-N-(1-pyridin-3-ylpropyl)pyridine-3-carboxamide (PubChem CID 74248524) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is N-methyl-2-(methylamino)-N-(1-pyridin-3-ylpropyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-2-(methylamino)-N-(1-pyridin-3-ylpropyl)pyridine-3-carboxamide
PubChem CID74248524
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC NameN-methyl-2-(methylamino)-N-(1-pyridin-3-ylpropyl)pyridine-3-carboxamide
SMILESCCC(c1cccnc1)N(C)C(=O)c1cccnc1NC
InChIInChI=1S/C16H20N4O/c1-4-14(12-7-5-9-18-11-12)20(3)16(21)13-8-6-10-19-15(13)17-2/h5-11,14H,4H2,1-3H3,(H,17,19)
InChIKeySHNOMOHJYVNFPF-UHFFFAOYSA-N
XLogP2.74
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-(methylamino)-N-propan-2-ylpyridine-3-carboxamide
CID 62166706
N-methyl-1-oxo-N-(1-pyridin-3-ylpropyl)-2H-isoquinoline-4-carboxamide
CID 74230073
N-(3,3-dimethylbutan-2-yl)-N-methyl-2-(methylamino)pyridine-3-carboxamide
CID 62180109
N-methyl-6-oxo-2-(phenoxymethyl)-N-[(1R)-1-pyridin-3-ylpropyl]-1H-pyrimidine-5-carboxamide
CID 97115377
N,2,5-trimethyl-1-phenyl-N-(1-pyridin-3-ylpropyl)pyrrole-3-carboxamide
CID 77084067
N-[1-(dimethylamino)propan-2-yl]-N-ethyl-2-(methylamino)pyridine-3-carboxamide
CID 103191074
N-(2-ethoxyphenyl)-N'-methyl-N'-(1-pyridin-3-ylpropyl)propanediamide
CID 50963279
N-methyl-2-(3-methyl-2-oxoimidazolidin-1-yl)-N-[(1R)-1-pyridin-3-ylpropyl]acetamide
CID 126454196
3-(4,6-dimethyl-2-pyridinyl)-N-methyl-N-[(1R)-1-pyridin-3-ylpropyl]benzamide
CID 125155931
3-[2-(1H-imidazol-5-yl)ethyl]-1-methyl-1-[(1R)-1-pyridin-3-ylpropyl]urea
CID 126434780
2-(methylamino)-N-(2-pyridin-3-ylethyl)pyridine-3-carboxamide
CID 62180569
1-amino-N-methyl-N-(1-pyridin-3-ylpropyl)cyclopentane-1-carboxamide;dihydrochloride
CID 154912060

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(methylamino)-N-(1-pyridin-3-ylpropyl)pyridine-3-carboxamide?
The IUPAC name of N-methyl-2-(methylamino)-N-(1-pyridin-3-ylpropyl)pyridine-3-carboxamide (CID 74248524) is N-methyl-2-(methylamino)-N-(1-pyridin-3-ylpropyl)pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-2-(methylamino)-N-(1-pyridin-3-ylpropyl)pyridine-3-carboxamide?
The canonical SMILES for N-methyl-2-(methylamino)-N-(1-pyridin-3-ylpropyl)pyridine-3-carboxamide is CCC(c1cccnc1)N(C)C(=O)c1cccnc1NC.
What is the InChIKey of N-methyl-2-(methylamino)-N-(1-pyridin-3-ylpropyl)pyridine-3-carboxamide?
The InChIKey is SHNOMOHJYVNFPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-4-14(12-7-5-9-18-11-12)20(3)16(21)13-8-6-10-19-15(13)17-2/h5-11,14H,4H2,1-3H3,(H,17,19).
What are the key properties of N-methyl-2-(methylamino)-N-(1-pyridin-3-ylpropyl)pyridine-3-carboxamide?
N-methyl-2-(methylamino)-N-(1-pyridin-3-ylpropyl)pyridine-3-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(methylamino)-N-(1-pyridin-3-ylpropyl)pyridine-3-carboxamide is sourced from PubChem (CID 74248524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).