6-[(1-ethylcyclopropyl)methylamino]-N,N-dimethylpyridine-3-carboxamide

C14H21N3O — CID 103736737

IUPAC6-[(1-ethylcyclopropyl)methylamino]-N,N-dimethylpyridine-3-carboxamide
SMILESCCC1(CNc2ccc(C(=O)N(C)C)cn2)CC1
InChIInChI=1S/C14H21N3O/c1-4-14(7-8-14)10-16-12-6-5-11(9-15-12)13(18)17(2)3/h5-6,9H,4,7-8,10H2,1-3H3,(H,15,16)
InChIKeyLBOFPPURHOQVET-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.39
Rot. Bonds5

About 6-[(1-ethylcyclopropyl)methylamino]-N,N-dimethylpyridine-3-carboxamide

6-[(1-ethylcyclopropyl)methylamino]-N,N-dimethylpyridine-3-carboxamide (PubChem CID 103736737) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 6-[(1-ethylcyclopropyl)methylamino]-N,N-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-[(1-ethylcyclopropyl)methylamino]-N,N-dimethylpyridine-3-carboxamide
PubChem CID103736737
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name6-[(1-ethylcyclopropyl)methylamino]-N,N-dimethylpyridine-3-carboxamide
SMILESCCC1(CNc2ccc(C(=O)N(C)C)cn2)CC1
InChIInChI=1S/C14H21N3O/c1-4-14(7-8-14)10-16-12-6-5-11(9-15-12)13(18)17(2)3/h5-6,9H,4,7-8,10H2,1-3H3,(H,15,16)
InChIKeyLBOFPPURHOQVET-UHFFFAOYSA-N
XLogP2.39
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-[[1-(2-methoxyethyl)cyclopropyl]methylamino]-N,N-dimethylpyridine-3-carboxamide
CID 103794664
N-ethyl-6-[(1-ethylcyclopropyl)methylamino]pyridine-3-carboxamide
CID 133338368
6-[[1-(dimethylamino)cyclobutyl]methylamino]-N,N-dimethylpyridine-3-carboxamide
CID 105418958
6-[(2-hydroxy-2-methylbutyl)amino]-N,N-dimethylpyridine-3-carboxamide
CID 78958778
N-[(1-ethylcyclopropyl)methyl]-5-methylpyridin-2-amine
CID 103736819
6-[[1-(2-aminoethyl)cyclopropyl]methylamino]pyridine-3-carboxamide
CID 114759134
2-[[[5-(dimethylcarbamoyl)-2-pyridinyl]amino]methyl]-2-ethylbutanoic acid
CID 115430029
6-[(2-hydroxy-2-propylpentyl)amino]-N,N-dimethylpyridine-3-carboxamide
CID 111435885
6-[[2-ethyl-2-(hydroxymethyl)butyl]amino]-N,N-dimethylpyridine-3-carboxamide
CID 103844430
N,N-dimethyl-6-(pentan-3-ylamino)pyridine-3-carboxamide
CID 78956363
6-(2,2-dimethylhydrazinyl)-N,N-dimethylpyridine-3-carboxamide
CID 83025620
6-(6-hydroxyhexylamino)-N,N-dimethylpyridine-3-carboxamide
CID 103918113

Frequently Asked Questions

What is the IUPAC name of 6-[(1-ethylcyclopropyl)methylamino]-N,N-dimethylpyridine-3-carboxamide?
The IUPAC name of 6-[(1-ethylcyclopropyl)methylamino]-N,N-dimethylpyridine-3-carboxamide (CID 103736737) is 6-[(1-ethylcyclopropyl)methylamino]-N,N-dimethylpyridine-3-carboxamide.
What is the SMILES notation for 6-[(1-ethylcyclopropyl)methylamino]-N,N-dimethylpyridine-3-carboxamide?
The canonical SMILES for 6-[(1-ethylcyclopropyl)methylamino]-N,N-dimethylpyridine-3-carboxamide is CCC1(CNc2ccc(C(=O)N(C)C)cn2)CC1.
What is the InChIKey of 6-[(1-ethylcyclopropyl)methylamino]-N,N-dimethylpyridine-3-carboxamide?
The InChIKey is LBOFPPURHOQVET-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-4-14(7-8-14)10-16-12-6-5-11(9-15-12)13(18)17(2)3/h5-6,9H,4,7-8,10H2,1-3H3,(H,15,16).
What are the key properties of 6-[(1-ethylcyclopropyl)methylamino]-N,N-dimethylpyridine-3-carboxamide?
6-[(1-ethylcyclopropyl)methylamino]-N,N-dimethylpyridine-3-carboxamide has a molecular weight of 247.34 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(1-ethylcyclopropyl)methylamino]-N,N-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 103736737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).