N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]piperidine-3-carboxamide;dihydrochloride

C16H33Cl2N3O2 — CID 119839517

IUPACN-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]piperidine-3-carboxamide;dihydrochloride
SMILESCC1CN(C(C)(C)CNC(=O)C2CCCNC2)CC(C)O1.Cl.Cl
InChIInChI=1S/C16H31N3O2.2ClH/c1-12-9-19(10-13(2)21-12)16(3,4)11-18-15(20)14-6-5-7-17-8-14;;/h12-14,17H,5-11H2,1-4H3,(H,18,20);2*1H
InChIKeyBKHGQRVVWHEHKV-UHFFFAOYSA-N
MW370.37 g/mol
LogP1.83
Rot. Bonds4

About N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]piperidine-3-carboxamide;dihydrochloride

N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]piperidine-3-carboxamide;dihydrochloride (PubChem CID 119839517) has the molecular formula C16H33Cl2N3O2 and a molecular weight of 370.37 g/mol. Its IUPAC name is N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]piperidine-3-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]piperidine-3-carboxamide;dihydrochloride
PubChem CID119839517
Molecular FormulaC16H33Cl2N3O2
Molecular Weight370.37 g/mol
Exact Mass369.19
IUPAC NameN-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]piperidine-3-carboxamide;dihydrochloride
SMILESCC1CN(C(C)(C)CNC(=O)C2CCCNC2)CC(C)O1.Cl.Cl
InChIInChI=1S/C16H31N3O2.2ClH/c1-12-9-19(10-13(2)21-12)16(3,4)11-18-15(20)14-6-5-7-17-8-14;;/h12-14,17H,5-11H2,1-4H3,(H,18,20);2*1H
InChIKeyBKHGQRVVWHEHKV-UHFFFAOYSA-N
XLogP1.83
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.37
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropyl]piperidine-3-carboxamide;dihydrochloride
CID 119849995
N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]pyrrolidine-3-carboxamide;dihydrochloride
CID 119884497
N-(2-methoxy-2-methylpropyl)piperidine-3-carboxamide
CID 115734334
N-ethylpiperidine-3-carboxamide;hydrochloride
CID 53410852
N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropyl]piperidine-3-carboxamide
CID 119849996
N-[[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]methyl]piperidine-3-carboxamide
CID 119305558
(3S)-N-[2-ethyl-2-(hydroxymethyl)butyl]piperidine-3-carboxamide
CID 114164701
3-hydroxy-3-methyl-4-[[(3R)-piperidine-3-carbonyl]amino]butanoic acid
CID 81133727
N-(2,2,3,3,3-pentafluoropropyl)piperidine-3-carboxamide
CID 162568495
[(2R,6S)-2,6-dimethylmorpholin-4-yl]-piperidin-3-ylmethanone
CID 103840886
(2,6-dimethylmorpholin-4-yl)-[(3S)-piperidin-3-yl]methanone
CID 81123196
(3S)-N-(2,2-difluoro-3-hydroxypropyl)piperidine-3-carboxamide
CID 106176675

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]piperidine-3-carboxamide;dihydrochloride?
The IUPAC name of N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]piperidine-3-carboxamide;dihydrochloride (CID 119839517) is N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]piperidine-3-carboxamide;dihydrochloride.
What is the SMILES notation for N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]piperidine-3-carboxamide;dihydrochloride?
The canonical SMILES for N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]piperidine-3-carboxamide;dihydrochloride is CC1CN(C(C)(C)CNC(=O)C2CCCNC2)CC(C)O1.Cl.Cl.
What is the InChIKey of N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]piperidine-3-carboxamide;dihydrochloride?
The InChIKey is BKHGQRVVWHEHKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O2.2ClH/c1-12-9-19(10-13(2)21-12)16(3,4)11-18-15(20)14-6-5-7-17-8-14;;/h12-14,17H,5-11H2,1-4H3,(H,18,20);2*1H.
What are the key properties of N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]piperidine-3-carboxamide;dihydrochloride?
N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]piperidine-3-carboxamide;dihydrochloride has a molecular weight of 370.37 g/mol, XLogP of 1.83, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,6-dimethylmorpholin-4-yl)-2-methylpropyl]piperidine-3-carboxamide;dihydrochloride is sourced from PubChem (CID 119839517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).