N,N,3-trimethyl-4-oxopiperidine-1-carboxamide

C9H16N2O2 — CID 114500015

IUPACN,N,3-trimethyl-4-oxopiperidine-1-carboxamide
SMILESCC1CN(C(=O)N(C)C)CCC1=O
InChIInChI=1S/C9H16N2O2/c1-7-6-11(5-4-8(7)12)9(13)10(2)3/h7H,4-6H2,1-3H3
InChIKeyAJIIPMRNXIRKEW-UHFFFAOYSA-N
MW184.24 g/mol
LogP0.58
Rot. Bonds

About N,N,3-trimethyl-4-oxopiperidine-1-carboxamide

N,N,3-trimethyl-4-oxopiperidine-1-carboxamide (PubChem CID 114500015) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is N,N,3-trimethyl-4-oxopiperidine-1-carboxamide.

Molecular Properties

Compound NameN,N,3-trimethyl-4-oxopiperidine-1-carboxamide
PubChem CID114500015
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC NameN,N,3-trimethyl-4-oxopiperidine-1-carboxamide
SMILESCC1CN(C(=O)N(C)C)CCC1=O
InChIInChI=1S/C9H16N2O2/c1-7-6-11(5-4-8(7)12)9(13)10(2)3/h7H,4-6H2,1-3H3
InChIKeyAJIIPMRNXIRKEW-UHFFFAOYSA-N
XLogP0.58
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 50.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl (3S)-3-methyl-4-oxopiperidine-1-carboxylate
CID 34180905
1-(cyclohexanecarbonyl)-3-methylpiperidin-4-one
CID 114499917
N-cyclohexyl-3-methyl-4-oxopiperidine-1-carboxamide
CID 114500022
3-(3-methyl-4-oxopiperidine-1-carbonyl)-1H-pyridazin-6-one
CID 102979094
3-methyl-1-(3-methyloxolane-2-carbonyl)piperidin-4-one
CID 114499767
N,N,3-trimethylpiperazine-1-carboxamide
CID 14090595
2-(3-methyl-4-oxopiperidin-1-yl)propanoic acid
CID 114500310
3-methyl-1-(5-methylfuran-3-carbonyl)piperidin-4-one
CID 114820820
3-methyl-1-(4-methylthiadiazole-5-carbonyl)piperidin-4-one
CID 114499698
1-(2,5-dimethylbenzoyl)-3-methylpiperidin-4-one
CID 114499914
N-benzyl-3-methyl-4-oxopiperidine-1-carboxamide
CID 107653612
3-methyl-1-(pyridine-3-carbonyl)piperidin-4-one
CID 114499676

Frequently Asked Questions

What is the IUPAC name of N,N,3-trimethyl-4-oxopiperidine-1-carboxamide?
The IUPAC name of N,N,3-trimethyl-4-oxopiperidine-1-carboxamide (CID 114500015) is N,N,3-trimethyl-4-oxopiperidine-1-carboxamide.
What is the SMILES notation for N,N,3-trimethyl-4-oxopiperidine-1-carboxamide?
The canonical SMILES for N,N,3-trimethyl-4-oxopiperidine-1-carboxamide is CC1CN(C(=O)N(C)C)CCC1=O.
What is the InChIKey of N,N,3-trimethyl-4-oxopiperidine-1-carboxamide?
The InChIKey is AJIIPMRNXIRKEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c1-7-6-11(5-4-8(7)12)9(13)10(2)3/h7H,4-6H2,1-3H3.
What are the key properties of N,N,3-trimethyl-4-oxopiperidine-1-carboxamide?
N,N,3-trimethyl-4-oxopiperidine-1-carboxamide has a molecular weight of 184.24 g/mol, XLogP of 0.58, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,3-trimethyl-4-oxopiperidine-1-carboxamide is sourced from PubChem (CID 114500015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).