N-ethyl-N-propyl-1,2,3,6-tetrahydropyridine-5-carboxamide;hydrochloride

C11H21ClN2O — CID 142231756

IUPACN-ethyl-N-propyl-1,2,3,6-tetrahydropyridine-5-carboxamide;hydrochloride
SMILESCCCN(CC)C(=O)C1=CCCNC1.Cl
InChIInChI=1S/C11H20N2O.ClH/c1-3-8-13(4-2)11(14)10-6-5-7-12-9-10;/h6,12H,3-5,7-9H2,1-2H3;1H
InChIKeyXEWRBZLVTVFUBH-UHFFFAOYSA-N
MW232.75 g/mol
LogP1.59
Rot. Bonds4

About N-ethyl-N-propyl-1,2,3,6-tetrahydropyridine-5-carboxamide;hydrochloride

N-ethyl-N-propyl-1,2,3,6-tetrahydropyridine-5-carboxamide;hydrochloride (PubChem CID 142231756) has the molecular formula C11H21ClN2O and a molecular weight of 232.75 g/mol. Its IUPAC name is N-ethyl-N-propyl-1,2,3,6-tetrahydropyridine-5-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-ethyl-N-propyl-1,2,3,6-tetrahydropyridine-5-carboxamide;hydrochloride
PubChem CID142231756
Molecular FormulaC11H21ClN2O
Molecular Weight232.75 g/mol
Exact Mass232.13
IUPAC NameN-ethyl-N-propyl-1,2,3,6-tetrahydropyridine-5-carboxamide;hydrochloride
SMILESCCCN(CC)C(=O)C1=CCCNC1.Cl
InChIInChI=1S/C11H20N2O.ClH/c1-3-8-13(4-2)11(14)10-6-5-7-12-9-10;/h6,12H,3-5,7-9H2,1-2H3;1H
InChIKeyXEWRBZLVTVFUBH-UHFFFAOYSA-N
XLogP1.59
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.75
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2-(1,2,3,6-tetrahydropyridin-5-yl)acetamide
CID 117125669
4-N-ethyl-1-N-(5-fluoro-1,2,3,4-tetrahydroisoquinolin-6-yl)-4-N-propylbenzene-1,4-dicarboxamide
CID 120881228
N,N-dibutyl-1-methyl-3,6-dihydro-2H-pyridine-5-carboxamide;oxalic acid
CID 132897269
N-cyclopropyl-N-[(2,3-dimethylphenyl)methyl]-1,2,3,6-tetrahydropyridine-5-carboxamide
CID 142846315
4-[ethyl(propyl)carbamoyl]benzoic acid
CID 43452972
N-(cyclopropylmethyl)-N-propyl-1,2,3,4-tetrahydroisoquinoline-5-carboxamide
CID 104558092
N-ethyl-4-(methoxymethyl)-N-propylpiperidine-4-carboxamide;hydrochloride
CID 120620366
2-amino-N-ethyl-6-methyl-N-propylbenzamide
CID 43268247
N-[2-(methylamino)-2-oxoethyl]-N-propyl-1,2,3,4-tetrahydroisoquinoline-5-carboxamide
CID 104558264
2-amino-4-N-ethyl-4-N-propyl-8-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)-3H-1-benzazepine-4,8-dicarboxamide
CID 167375470
N,N-dipropylpiperidine-4-carboxamide;hydrochloride
CID 53410679
3-chloro-N-ethyl-N-propylpyridine-4-carboxamide
CID 66463826

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-propyl-1,2,3,6-tetrahydropyridine-5-carboxamide;hydrochloride?
The IUPAC name of N-ethyl-N-propyl-1,2,3,6-tetrahydropyridine-5-carboxamide;hydrochloride (CID 142231756) is N-ethyl-N-propyl-1,2,3,6-tetrahydropyridine-5-carboxamide;hydrochloride.
What is the SMILES notation for N-ethyl-N-propyl-1,2,3,6-tetrahydropyridine-5-carboxamide;hydrochloride?
The canonical SMILES for N-ethyl-N-propyl-1,2,3,6-tetrahydropyridine-5-carboxamide;hydrochloride is CCCN(CC)C(=O)C1=CCCNC1.Cl.
What is the InChIKey of N-ethyl-N-propyl-1,2,3,6-tetrahydropyridine-5-carboxamide;hydrochloride?
The InChIKey is XEWRBZLVTVFUBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O.ClH/c1-3-8-13(4-2)11(14)10-6-5-7-12-9-10;/h6,12H,3-5,7-9H2,1-2H3;1H.
What are the key properties of N-ethyl-N-propyl-1,2,3,6-tetrahydropyridine-5-carboxamide;hydrochloride?
N-ethyl-N-propyl-1,2,3,6-tetrahydropyridine-5-carboxamide;hydrochloride has a molecular weight of 232.75 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-propyl-1,2,3,6-tetrahydropyridine-5-carboxamide;hydrochloride is sourced from PubChem (CID 142231756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).