N,N-dimethyl-1-[(2S)-piperidine-2-carbonyl]piperidine-4-carboxamide;hydrochloride

C14H26ClN3O2 — CID 119687527

IUPACN,N-dimethyl-1-[(2S)-piperidine-2-carbonyl]piperidine-4-carboxamide;hydrochloride
SMILESCN(C)C(=O)C1CCN(C(=O)[C@@H]2CCCCN2)CC1.Cl
InChIInChI=1S/C14H25N3O2.ClH/c1-16(2)13(18)11-6-9-17(10-7-11)14(19)12-5-3-4-8-15-12;/h11-12,15H,3-10H2,1-2H3;1H/t12-;/m0./s1
InChIKeyJXLIYCKRHHXZDM-YDALLXLXSA-N
MW303.83 g/mol
LogP0.88
Rot. Bonds2

About N,N-dimethyl-1-[(2S)-piperidine-2-carbonyl]piperidine-4-carboxamide;hydrochloride

N,N-dimethyl-1-[(2S)-piperidine-2-carbonyl]piperidine-4-carboxamide;hydrochloride (PubChem CID 119687527) has the molecular formula C14H26ClN3O2 and a molecular weight of 303.83 g/mol. Its IUPAC name is N,N-dimethyl-1-[(2S)-piperidine-2-carbonyl]piperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN,N-dimethyl-1-[(2S)-piperidine-2-carbonyl]piperidine-4-carboxamide;hydrochloride
PubChem CID119687527
Molecular FormulaC14H26ClN3O2
Molecular Weight303.83 g/mol
Exact Mass303.17
IUPAC NameN,N-dimethyl-1-[(2S)-piperidine-2-carbonyl]piperidine-4-carboxamide;hydrochloride
SMILESCN(C)C(=O)C1CCN(C(=O)[C@@H]2CCCCN2)CC1.Cl
InChIInChI=1S/C14H25N3O2.ClH/c1-16(2)13(18)11-6-9-17(10-7-11)14(19)12-5-3-4-8-15-12;/h11-12,15H,3-10H2,1-2H3;1H/t12-;/m0./s1
InChIKeyJXLIYCKRHHXZDM-YDALLXLXSA-N
XLogP0.88
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.83
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-1-[(2S)-piperidine-2-carbonyl]piperidine-4-carboxamide
CID 93370935
[4-(dimethylamino)piperidin-1-yl]-[(2S)-piperidin-2-yl]methanone;dihydrochloride
CID 119958508
azepan-1-yl-[(2S)-piperidin-2-yl]methanone;hydrochloride
CID 119669545
azocan-1-yl-[(2S)-piperidin-2-yl]methanone;hydrochloride
CID 119676414
(4-methylpiperidin-1-yl)-piperidin-2-ylmethanone;hydrochloride
CID 2794697
azepan-1-yl(azepan-2-yl)methanone
CID 64562203
azepan-1-yl-[(2R)-piperidin-2-yl]methanone
CID 7183049
N-methyl-1-[(2R)-piperidine-2-carbonyl]piperidine-4-carboxamide
CID 93173904
[3-(dimethylamino)pyrrolidin-1-yl]-[(2S)-piperidin-2-yl]methanone
CID 104913920
pyrrolidin-1-yl(pyrrolidin-2-yl)methanone
CID 550904
(4,4-dimethylpiperidin-1-yl)-piperidin-2-ylmethanone;hydrochloride
CID 119316184
[4-(1-hydroxyethyl)piperidin-1-yl]-[(2S)-piperidin-2-yl]methanone;hydrochloride
CID 119769016

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[(2S)-piperidine-2-carbonyl]piperidine-4-carboxamide;hydrochloride?
The IUPAC name of N,N-dimethyl-1-[(2S)-piperidine-2-carbonyl]piperidine-4-carboxamide;hydrochloride (CID 119687527) is N,N-dimethyl-1-[(2S)-piperidine-2-carbonyl]piperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N,N-dimethyl-1-[(2S)-piperidine-2-carbonyl]piperidine-4-carboxamide;hydrochloride?
The canonical SMILES for N,N-dimethyl-1-[(2S)-piperidine-2-carbonyl]piperidine-4-carboxamide;hydrochloride is CN(C)C(=O)C1CCN(C(=O)[C@@H]2CCCCN2)CC1.Cl.
What is the InChIKey of N,N-dimethyl-1-[(2S)-piperidine-2-carbonyl]piperidine-4-carboxamide;hydrochloride?
The InChIKey is JXLIYCKRHHXZDM-YDALLXLXSA-N. The full InChI is InChI=1S/C14H25N3O2.ClH/c1-16(2)13(18)11-6-9-17(10-7-11)14(19)12-5-3-4-8-15-12;/h11-12,15H,3-10H2,1-2H3;1H/t12-;/m0./s1.
What are the key properties of N,N-dimethyl-1-[(2S)-piperidine-2-carbonyl]piperidine-4-carboxamide;hydrochloride?
N,N-dimethyl-1-[(2S)-piperidine-2-carbonyl]piperidine-4-carboxamide;hydrochloride has a molecular weight of 303.83 g/mol, XLogP of 0.88, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[(2S)-piperidine-2-carbonyl]piperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119687527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).