N-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]piperidine-3-carboxamide;dihydrochloride

C16H26Cl2N4O2 — CID 119873294

IUPACN-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]piperidine-3-carboxamide;dihydrochloride
SMILESCN(CCc1ccccn1)C(=O)CNC(=O)C1CCCNC1.Cl.Cl
InChIInChI=1S/C16H24N4O2.2ClH/c1-20(10-7-14-6-2-3-9-18-14)15(21)12-19-16(22)13-5-4-8-17-11-13;;/h2-3,6,9,13,17H,4-5,7-8,10-12H2,1H3,(H,19,22);2*1H
InChIKeyCGXRNGDJOZVETL-UHFFFAOYSA-N
MW377.32 g/mol
LogP1.04
Rot. Bonds6

About N-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]piperidine-3-carboxamide;dihydrochloride

N-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]piperidine-3-carboxamide;dihydrochloride (PubChem CID 119873294) has the molecular formula C16H26Cl2N4O2 and a molecular weight of 377.32 g/mol. Its IUPAC name is N-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]piperidine-3-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]piperidine-3-carboxamide;dihydrochloride
PubChem CID119873294
Molecular FormulaC16H26Cl2N4O2
Molecular Weight377.32 g/mol
Exact Mass376.14
IUPAC NameN-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]piperidine-3-carboxamide;dihydrochloride
SMILESCN(CCc1ccccn1)C(=O)CNC(=O)C1CCCNC1.Cl.Cl
InChIInChI=1S/C16H24N4O2.2ClH/c1-20(10-7-14-6-2-3-9-18-14)15(21)12-19-16(22)13-5-4-8-17-11-13;;/h2-3,6,9,13,17H,4-5,7-8,10-12H2,1H3,(H,19,22);2*1H
InChIKeyCGXRNGDJOZVETL-UHFFFAOYSA-N
XLogP1.04
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.32
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]-2-pyrrolidin-2-ylacetamide;dihydrochloride
CID 119873338
(3R)-N-[2-(dimethylamino)-2-oxoethyl]piperidine-3-carboxamide
CID 81123203
N-(3-pyridin-2-ylpropyl)azepane-4-carboxamide;dihydrochloride
CID 154910386
1-amino-N-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]cyclopentane-1-carboxamide
CID 119873315
2-(4-aminophenyl)-N-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]acetamide;dihydrochloride
CID 119873300
N-(3-pyridin-2-ylpropyl)azepane-4-carboxamide
CID 122565402
N-[2-[benzyl(ethyl)amino]-2-oxoethyl]piperidine-3-carboxamide;hydrochloride
CID 119304521
N-methyl-2-piperidin-3-yl-N-(pyridin-2-ylmethyl)acetamide
CID 55105100
(2S)-2-amino-3,3-dimethyl-N-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]butanamide;dihydrochloride
CID 119873322
4-amino-N-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]pentanamide
CID 120565270
(3S)-N-[(1R)-1-pyridin-2-ylethyl]piperidine-3-carboxamide
CID 81407106
(3S)-N-propan-2-yl-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide
CID 81129457

Frequently Asked Questions

What is the IUPAC name of N-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]piperidine-3-carboxamide;dihydrochloride?
The IUPAC name of N-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]piperidine-3-carboxamide;dihydrochloride (CID 119873294) is N-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]piperidine-3-carboxamide;dihydrochloride.
What is the SMILES notation for N-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]piperidine-3-carboxamide;dihydrochloride?
The canonical SMILES for N-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]piperidine-3-carboxamide;dihydrochloride is CN(CCc1ccccn1)C(=O)CNC(=O)C1CCCNC1.Cl.Cl.
What is the InChIKey of N-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]piperidine-3-carboxamide;dihydrochloride?
The InChIKey is CGXRNGDJOZVETL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O2.2ClH/c1-20(10-7-14-6-2-3-9-18-14)15(21)12-19-16(22)13-5-4-8-17-11-13;;/h2-3,6,9,13,17H,4-5,7-8,10-12H2,1H3,(H,19,22);2*1H.
What are the key properties of N-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]piperidine-3-carboxamide;dihydrochloride?
N-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]piperidine-3-carboxamide;dihydrochloride has a molecular weight of 377.32 g/mol, XLogP of 1.04, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]piperidine-3-carboxamide;dihydrochloride is sourced from PubChem (CID 119873294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).