N-(3-ethyl-2-pyrrolidin-1-ylpentyl)piperidine-3-carboxamide;dihydrochloride

C17H35Cl2N3O — CID 119842158

IUPACN-(3-ethyl-2-pyrrolidin-1-ylpentyl)piperidine-3-carboxamide;dihydrochloride
SMILESCCC(CC)C(CNC(=O)C1CCCNC1)N1CCCC1.Cl.Cl
InChIInChI=1S/C17H33N3O.2ClH/c1-3-14(4-2)16(20-10-5-6-11-20)13-19-17(21)15-8-7-9-18-12-15;;/h14-16,18H,3-13H2,1-2H3,(H,19,21);2*1H
InChIKeyGCOZTUUSBRTDST-UHFFFAOYSA-N
MW368.39 g/mol
LogP2.85
Rot. Bonds7

About N-(3-ethyl-2-pyrrolidin-1-ylpentyl)piperidine-3-carboxamide;dihydrochloride

N-(3-ethyl-2-pyrrolidin-1-ylpentyl)piperidine-3-carboxamide;dihydrochloride (PubChem CID 119842158) has the molecular formula C17H35Cl2N3O and a molecular weight of 368.39 g/mol. Its IUPAC name is N-(3-ethyl-2-pyrrolidin-1-ylpentyl)piperidine-3-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-(3-ethyl-2-pyrrolidin-1-ylpentyl)piperidine-3-carboxamide;dihydrochloride
PubChem CID119842158
Molecular FormulaC17H35Cl2N3O
Molecular Weight368.39 g/mol
Exact Mass367.22
IUPAC NameN-(3-ethyl-2-pyrrolidin-1-ylpentyl)piperidine-3-carboxamide;dihydrochloride
SMILESCCC(CC)C(CNC(=O)C1CCCNC1)N1CCCC1.Cl.Cl
InChIInChI=1S/C17H33N3O.2ClH/c1-3-14(4-2)16(20-10-5-6-11-20)13-19-17(21)15-8-7-9-18-12-15;;/h14-16,18H,3-13H2,1-2H3,(H,19,21);2*1H
InChIKeyGCOZTUUSBRTDST-UHFFFAOYSA-N
XLogP2.85
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.39
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethylpiperidine-3-carboxamide;hydrochloride
CID 53410852
N-(2,3-dimethylbutyl)piperidine-3-carboxamide;hydrochloride
CID 119330823
N-(3-ethyl-2-hydroxypentyl)pyrrolidine-3-carboxamide
CID 103811158
N-(3-ethyl-2-pyrrolidin-1-ylpentyl)morpholine-3-carboxamide;dihydrochloride
CID 119842166
(3R)-N-(2-ethylhexyl)piperidine-3-carboxamide
CID 81141050
N-(2,3-dihydroxypropyl)piperidine-3-carboxamide
CID 66169749
2-hydroxy-3-[[(3R)-piperidine-3-carbonyl]amino]propanoic acid
CID 81134818
N-(2-cyclopropyl-2-hydroxyethyl)piperidine-3-carboxamide
CID 63297016
methyl 2-hydroxy-3-[[(3S)-piperidine-3-carbonyl]amino]propanoate
CID 107222681
propan-2-yl 2-methyl-3-(piperidine-3-carbonylamino)propanoate;hydrochloride
CID 119338471
N-(2-ethylsulfonylethyl)piperidine-3-carboxamide;hydrochloride
CID 119317688
2-(piperidine-3-carbonylamino)butanoic acid
CID 61159662

Frequently Asked Questions

What is the IUPAC name of N-(3-ethyl-2-pyrrolidin-1-ylpentyl)piperidine-3-carboxamide;dihydrochloride?
The IUPAC name of N-(3-ethyl-2-pyrrolidin-1-ylpentyl)piperidine-3-carboxamide;dihydrochloride (CID 119842158) is N-(3-ethyl-2-pyrrolidin-1-ylpentyl)piperidine-3-carboxamide;dihydrochloride.
What is the SMILES notation for N-(3-ethyl-2-pyrrolidin-1-ylpentyl)piperidine-3-carboxamide;dihydrochloride?
The canonical SMILES for N-(3-ethyl-2-pyrrolidin-1-ylpentyl)piperidine-3-carboxamide;dihydrochloride is CCC(CC)C(CNC(=O)C1CCCNC1)N1CCCC1.Cl.Cl.
What is the InChIKey of N-(3-ethyl-2-pyrrolidin-1-ylpentyl)piperidine-3-carboxamide;dihydrochloride?
The InChIKey is GCOZTUUSBRTDST-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N3O.2ClH/c1-3-14(4-2)16(20-10-5-6-11-20)13-19-17(21)15-8-7-9-18-12-15;;/h14-16,18H,3-13H2,1-2H3,(H,19,21);2*1H.
What are the key properties of N-(3-ethyl-2-pyrrolidin-1-ylpentyl)piperidine-3-carboxamide;dihydrochloride?
N-(3-ethyl-2-pyrrolidin-1-ylpentyl)piperidine-3-carboxamide;dihydrochloride has a molecular weight of 368.39 g/mol, XLogP of 2.85, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethyl-2-pyrrolidin-1-ylpentyl)piperidine-3-carboxamide;dihydrochloride is sourced from PubChem (CID 119842158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).