N-ethyl-2-(piperazine-1-carbonyl)pyrrolidine-1-carboxamide

C12H22N4O2 — CID 61176280

IUPACN-ethyl-2-(piperazine-1-carbonyl)pyrrolidine-1-carboxamide
SMILESCCNC(=O)N1CCCC1C(=O)N1CCNCC1
InChIInChI=1S/C12H22N4O2/c1-2-14-12(18)16-7-3-4-10(16)11(17)15-8-5-13-6-9-15/h10,13H,2-9H2,1H3,(H,14,18)
InChIKeyWOUMDUHVTRVSNW-UHFFFAOYSA-N
MW254.33 g/mol
LogP-0.39
Rot. Bonds2

About N-ethyl-2-(piperazine-1-carbonyl)pyrrolidine-1-carboxamide

N-ethyl-2-(piperazine-1-carbonyl)pyrrolidine-1-carboxamide (PubChem CID 61176280) has the molecular formula C12H22N4O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is N-ethyl-2-(piperazine-1-carbonyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-ethyl-2-(piperazine-1-carbonyl)pyrrolidine-1-carboxamide
PubChem CID61176280
Molecular FormulaC12H22N4O2
Molecular Weight254.33 g/mol
Exact Mass254.17
IUPAC NameN-ethyl-2-(piperazine-1-carbonyl)pyrrolidine-1-carboxamide
SMILESCCNC(=O)N1CCCC1C(=O)N1CCNCC1
InChIInChI=1S/C12H22N4O2/c1-2-14-12(18)16-7-3-4-10(16)11(17)15-8-5-13-6-9-15/h10,13H,2-9H2,1H3,(H,14,18)
InChIKeyWOUMDUHVTRVSNW-UHFFFAOYSA-N
XLogP-0.39
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 5-0.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-1-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]propan-1-one
CID 61174938
N,N-dimethyl-2-(piperazine-1-carbonyl)pyrrolidine-1-carboxamide
CID 79154087
2-cyclopentyl-1-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]ethanone
CID 61175911
(2S)-1-(ethylcarbamoyl)piperidine-2-carboxylic acid
CID 66264798
2-tert-butylsulfanyl-1-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]ethanone
CID 61176844
N-ethylpiperazine-1-carboxamide
CID 9207783
1-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]but-3-en-1-one
CID 62677215
2-methylpropyl 2-(piperazine-1-carbonyl)pyrrolidine-1-carboxylate
CID 61176281
2-[(2-methylpropan-2-yl)oxy]-1-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]ethanone
CID 115949467
1-[2-(1,4-diazepane-1-carbonyl)pyrrolidin-1-yl]-3,3-dimethylbutan-1-one;hydrochloride
CID 119415727
1-[2-(piperazine-1-carbonyl)pyrrolidin-1-yl]pent-4-en-1-one
CID 62677214
(2R)-1-[[2-(ethylamino)-2-oxoethyl]carbamoyl]pyrrolidine-2-carboxylic acid
CID 55151526

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(piperazine-1-carbonyl)pyrrolidine-1-carboxamide?
The IUPAC name of N-ethyl-2-(piperazine-1-carbonyl)pyrrolidine-1-carboxamide (CID 61176280) is N-ethyl-2-(piperazine-1-carbonyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-ethyl-2-(piperazine-1-carbonyl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-ethyl-2-(piperazine-1-carbonyl)pyrrolidine-1-carboxamide is CCNC(=O)N1CCCC1C(=O)N1CCNCC1.
What is the InChIKey of N-ethyl-2-(piperazine-1-carbonyl)pyrrolidine-1-carboxamide?
The InChIKey is WOUMDUHVTRVSNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O2/c1-2-14-12(18)16-7-3-4-10(16)11(17)15-8-5-13-6-9-15/h10,13H,2-9H2,1H3,(H,14,18).
What are the key properties of N-ethyl-2-(piperazine-1-carbonyl)pyrrolidine-1-carboxamide?
N-ethyl-2-(piperazine-1-carbonyl)pyrrolidine-1-carboxamide has a molecular weight of 254.33 g/mol, XLogP of -0.39, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(piperazine-1-carbonyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 61176280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).