N-methyl-1-[(2S)-piperidine-2-carbonyl]piperidine-3-carboxamide;hydrochloride

C13H24ClN3O2 — CID 119783429

IUPACN-methyl-1-[(2S)-piperidine-2-carbonyl]piperidine-3-carboxamide;hydrochloride
SMILESCNC(=O)C1CCCN(C(=O)[C@@H]2CCCCN2)C1.Cl
InChIInChI=1S/C13H23N3O2.ClH/c1-14-12(17)10-5-4-8-16(9-10)13(18)11-6-2-3-7-15-11;/h10-11,15H,2-9H2,1H3,(H,14,17);1H/t10?,11-;/m0./s1
InChIKeyBCDWVJIUKZBPQO-GQNCZFCYSA-N
MW289.81 g/mol
LogP0.53
Rot. Bonds2

About N-methyl-1-[(2S)-piperidine-2-carbonyl]piperidine-3-carboxamide;hydrochloride

N-methyl-1-[(2S)-piperidine-2-carbonyl]piperidine-3-carboxamide;hydrochloride (PubChem CID 119783429) has the molecular formula C13H24ClN3O2 and a molecular weight of 289.81 g/mol. Its IUPAC name is N-methyl-1-[(2S)-piperidine-2-carbonyl]piperidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-methyl-1-[(2S)-piperidine-2-carbonyl]piperidine-3-carboxamide;hydrochloride
PubChem CID119783429
Molecular FormulaC13H24ClN3O2
Molecular Weight289.81 g/mol
Exact Mass289.16
IUPAC NameN-methyl-1-[(2S)-piperidine-2-carbonyl]piperidine-3-carboxamide;hydrochloride
SMILESCNC(=O)C1CCCN(C(=O)[C@@H]2CCCCN2)C1.Cl
InChIInChI=1S/C13H23N3O2.ClH/c1-14-12(17)10-5-4-8-16(9-10)13(18)11-6-2-3-7-15-11;/h10-11,15H,2-9H2,1H3,(H,14,17);1H/t10?,11-;/m0./s1
InChIKeyBCDWVJIUKZBPQO-GQNCZFCYSA-N
XLogP0.53
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.81
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-propan-2-yl-1-[(2R)-pyrrolidine-2-carbonyl]piperidine-3-carboxamide
CID 53015059
N-methyl-1-[(2R)-piperidine-2-carbonyl]piperidine-4-carboxamide
CID 93173904
N-methyl-1-(4-methylpiperidine-2-carbonyl)piperidine-3-carboxamide
CID 103195214
N-(cyclopropylmethyl)-1-(piperidine-2-carbonyl)piperidine-3-carboxamide;hydrochloride
CID 119289763
azepan-1-yl-[(2S)-piperidin-2-yl]methanone;hydrochloride
CID 119669545
azocan-1-yl-[(2S)-piperidin-2-yl]methanone;hydrochloride
CID 119676414
N-butyl-1-(piperidine-2-carbonyl)piperidine-3-carboxamide
CID 119311468
azepan-1-yl(azepan-2-yl)methanone
CID 64562203
azepan-1-yl-[(2R)-piperidin-2-yl]methanone
CID 7183049
(3S)-1-[(2S)-pyrrolidine-2-carbonyl]piperidine-3-carboxylic acid
CID 81125629
N-(cyclopropylmethyl)-1-(pyrrolidine-2-carbonyl)piperidine-3-carboxamide
CID 119289774
morpholin-4-yl-[1-(piperidine-2-carbonyl)piperidin-3-yl]methanone
CID 119277055

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[(2S)-piperidine-2-carbonyl]piperidine-3-carboxamide;hydrochloride?
The IUPAC name of N-methyl-1-[(2S)-piperidine-2-carbonyl]piperidine-3-carboxamide;hydrochloride (CID 119783429) is N-methyl-1-[(2S)-piperidine-2-carbonyl]piperidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-methyl-1-[(2S)-piperidine-2-carbonyl]piperidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-methyl-1-[(2S)-piperidine-2-carbonyl]piperidine-3-carboxamide;hydrochloride is CNC(=O)C1CCCN(C(=O)[C@@H]2CCCCN2)C1.Cl.
What is the InChIKey of N-methyl-1-[(2S)-piperidine-2-carbonyl]piperidine-3-carboxamide;hydrochloride?
The InChIKey is BCDWVJIUKZBPQO-GQNCZFCYSA-N. The full InChI is InChI=1S/C13H23N3O2.ClH/c1-14-12(17)10-5-4-8-16(9-10)13(18)11-6-2-3-7-15-11;/h10-11,15H,2-9H2,1H3,(H,14,17);1H/t10?,11-;/m0./s1.
What are the key properties of N-methyl-1-[(2S)-piperidine-2-carbonyl]piperidine-3-carboxamide;hydrochloride?
N-methyl-1-[(2S)-piperidine-2-carbonyl]piperidine-3-carboxamide;hydrochloride has a molecular weight of 289.81 g/mol, XLogP of 0.53, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[(2S)-piperidine-2-carbonyl]piperidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119783429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).