N-[1-(ethylamino)-1-oxopropan-2-yl]-2-methylpiperidine-2-carboxamide

C12H23N3O2 — CID 113368563

IUPACN-[1-(ethylamino)-1-oxopropan-2-yl]-2-methylpiperidine-2-carboxamide
SMILESCCNC(=O)C(C)NC(=O)C1(C)CCCCN1
InChIInChI=1S/C12H23N3O2/c1-4-13-10(16)9(2)15-11(17)12(3)7-5-6-8-14-12/h9,14H,4-8H2,1-3H3,(H,13,16)(H,15,17)
InChIKeyLWBMPJRESMSQMN-UHFFFAOYSA-N
MW241.33 g/mol
LogP0.16
Rot. Bonds4

About N-[1-(ethylamino)-1-oxopropan-2-yl]-2-methylpiperidine-2-carboxamide

N-[1-(ethylamino)-1-oxopropan-2-yl]-2-methylpiperidine-2-carboxamide (PubChem CID 113368563) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is N-[1-(ethylamino)-1-oxopropan-2-yl]-2-methylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(ethylamino)-1-oxopropan-2-yl]-2-methylpiperidine-2-carboxamide
PubChem CID113368563
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC NameN-[1-(ethylamino)-1-oxopropan-2-yl]-2-methylpiperidine-2-carboxamide
SMILESCCNC(=O)C(C)NC(=O)C1(C)CCCCN1
InChIInChI=1S/C12H23N3O2/c1-4-13-10(16)9(2)15-11(17)12(3)7-5-6-8-14-12/h9,14H,4-8H2,1-3H3,(H,13,16)(H,15,17)
InChIKeyLWBMPJRESMSQMN-UHFFFAOYSA-N
XLogP0.16
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 50.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2S)-1-hydroxypropan-2-yl]-2-methylpiperidine-2-carboxamide
CID 107218975
N-[1-(tert-butylamino)-1-oxopropan-2-yl]-2-methylpyrrolidine-2-carboxamide
CID 112702823
(2S)-3-hydroxy-2-[(2-methylpiperidine-2-carbonyl)amino]propanoic acid
CID 104596612
(2R)-2-methyl-N-[(2R)-1-(2-methylpropoxy)propan-2-yl]piperidine-2-carboxamide
CID 99853203
1-[[1-(ethylamino)-1-oxopropan-2-yl]carbamoyl]cyclobutane-1-carboxylic acid
CID 55035123
N-[(1R)-1-cycloheptylethyl]-2-methylpiperidine-2-carboxamide
CID 104597083
3-methoxy-4-[(2-methylpiperidine-2-carbonyl)amino]butanoic acid
CID 103156961
N-(2,3-dihydroxypropyl)-2-methylpiperidine-2-carboxamide
CID 104596953
(2S)-5-amino-2-[(2-methylpiperidine-2-carbonyl)amino]-5-oxopentanoic acid
CID 104596611
N-[(1-hydroxy-4,4-dimethylcyclohexyl)methyl]-2-methylpiperidine-2-carboxamide
CID 104596903
(2R)-5-methoxy-2-[(2-methylpiperidine-2-carbonyl)amino]-5-oxopentanoic acid
CID 107824378
N-(3-hydroxy-2-methylpropyl)-2-methylpyrrolidine-2-carboxamide
CID 65036100

Frequently Asked Questions

What is the IUPAC name of N-[1-(ethylamino)-1-oxopropan-2-yl]-2-methylpiperidine-2-carboxamide?
The IUPAC name of N-[1-(ethylamino)-1-oxopropan-2-yl]-2-methylpiperidine-2-carboxamide (CID 113368563) is N-[1-(ethylamino)-1-oxopropan-2-yl]-2-methylpiperidine-2-carboxamide.
What is the SMILES notation for N-[1-(ethylamino)-1-oxopropan-2-yl]-2-methylpiperidine-2-carboxamide?
The canonical SMILES for N-[1-(ethylamino)-1-oxopropan-2-yl]-2-methylpiperidine-2-carboxamide is CCNC(=O)C(C)NC(=O)C1(C)CCCCN1.
What is the InChIKey of N-[1-(ethylamino)-1-oxopropan-2-yl]-2-methylpiperidine-2-carboxamide?
The InChIKey is LWBMPJRESMSQMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-4-13-10(16)9(2)15-11(17)12(3)7-5-6-8-14-12/h9,14H,4-8H2,1-3H3,(H,13,16)(H,15,17).
What are the key properties of N-[1-(ethylamino)-1-oxopropan-2-yl]-2-methylpiperidine-2-carboxamide?
N-[1-(ethylamino)-1-oxopropan-2-yl]-2-methylpiperidine-2-carboxamide has a molecular weight of 241.33 g/mol, XLogP of 0.16, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(ethylamino)-1-oxopropan-2-yl]-2-methylpiperidine-2-carboxamide is sourced from PubChem (CID 113368563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).