N,N,4-trimethyl-3,6-dihydro-2H-pyridine-1-carboxamide

C9H16N2O — CID 115766538

IUPACN,N,4-trimethyl-3,6-dihydro-2H-pyridine-1-carboxamide
SMILESCC1=CCN(C(=O)N(C)C)CC1
InChIInChI=1S/C9H16N2O/c1-8-4-6-11(7-5-8)9(12)10(2)3/h4H,5-7H2,1-3H3
InChIKeyOYKQVIQGXGEVIC-UHFFFAOYSA-N
MW168.24 g/mol
LogP1.32
Rot. Bonds

About N,N,4-trimethyl-3,6-dihydro-2H-pyridine-1-carboxamide

N,N,4-trimethyl-3,6-dihydro-2H-pyridine-1-carboxamide (PubChem CID 115766538) has the molecular formula C9H16N2O and a molecular weight of 168.24 g/mol. Its IUPAC name is N,N,4-trimethyl-3,6-dihydro-2H-pyridine-1-carboxamide.

Molecular Properties

Compound NameN,N,4-trimethyl-3,6-dihydro-2H-pyridine-1-carboxamide
PubChem CID115766538
Molecular FormulaC9H16N2O
Molecular Weight168.24 g/mol
Exact Mass168.13
IUPAC NameN,N,4-trimethyl-3,6-dihydro-2H-pyridine-1-carboxamide
SMILESCC1=CCN(C(=O)N(C)C)CC1
InChIInChI=1S/C9H16N2O/c1-8-4-6-11(7-5-8)9(12)10(2)3/h4H,5-7H2,1-3H3
InChIKeyOYKQVIQGXGEVIC-UHFFFAOYSA-N
XLogP1.32
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(3,3-difluoroazetidin-1-yl)-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)methanone;ethane
CID 177162177
(3,3-difluoroazetidin-1-yl)-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)methanone
CID 177162178
(3,3-difluoroazetidin-1-yl)-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)methanone;ethane
CID 177162861
4-[(Z)-but-2-en-2-yl]-1,3-diethylimidazolidin-2-one
CID 102351243
N-ethyl-N-methyl-4-(trifluoromethyl)-3,6-dihydro-2H-pyridine-1-carboxamide
CID 114489749
N,N-dimethyl-4-(trifluoromethyl)-3,6-dihydro-2H-pyridine-1-carboxamide
CID 115769621
N,N-diethyl-4-(trifluoromethyl)-3,6-dihydro-2H-pyridine-1-carboxamide
CID 115770409
N-(3-fluorobutyl)-5-methyl-3,6-dihydro-2H-pyridine-1-carboxamide
CID 126790709
5-fluoro-N-(3-methylbut-3-enyl)-3,6-dihydro-2H-pyridine-1-carboxamide
CID 126793933
N-(3-fluorobutyl)-4-methyl-3,6-dihydro-2H-pyridine-1-carboxamide
CID 126793953
N,N,4,5-tetramethyl-3,6-dihydro-2H-pyridine-1-carboxamide
CID 18728229
1-[[Butyl(methyl)amino]methyl]-1-ethyl-3-methyl-3-(4-methylpent-3-enyl)urea
CID 54094704

Frequently Asked Questions

What is the IUPAC name of N,N,4-trimethyl-3,6-dihydro-2H-pyridine-1-carboxamide?
The IUPAC name of N,N,4-trimethyl-3,6-dihydro-2H-pyridine-1-carboxamide (CID 115766538) is N,N,4-trimethyl-3,6-dihydro-2H-pyridine-1-carboxamide.
What is the SMILES notation for N,N,4-trimethyl-3,6-dihydro-2H-pyridine-1-carboxamide?
The canonical SMILES for N,N,4-trimethyl-3,6-dihydro-2H-pyridine-1-carboxamide is CC1=CCN(C(=O)N(C)C)CC1.
What is the InChIKey of N,N,4-trimethyl-3,6-dihydro-2H-pyridine-1-carboxamide?
The InChIKey is OYKQVIQGXGEVIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O/c1-8-4-6-11(7-5-8)9(12)10(2)3/h4H,5-7H2,1-3H3.
What are the key properties of N,N,4-trimethyl-3,6-dihydro-2H-pyridine-1-carboxamide?
N,N,4-trimethyl-3,6-dihydro-2H-pyridine-1-carboxamide has a molecular weight of 168.24 g/mol, XLogP of 1.32, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,4-trimethyl-3,6-dihydro-2H-pyridine-1-carboxamide is sourced from PubChem (CID 115766538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).