4-(2-aminocyclohexanecarbonyl)-N-ethylpiperazine-1-carboxamide

C14H26N4O2 — CID 64825150

IUPAC4-(2-aminocyclohexanecarbonyl)-N-ethylpiperazine-1-carboxamide
SMILESCCNC(=O)N1CCN(C(=O)C2CCCCC2N)CC1
InChIInChI=1S/C14H26N4O2/c1-2-16-14(20)18-9-7-17(8-10-18)13(19)11-5-3-4-6-12(11)15/h11-12H,2-10,15H2,1H3,(H,16,20)
InChIKeyKEPDLWVLRBFIOC-UHFFFAOYSA-N
MW282.39 g/mol
LogP0.38
Rot. Bonds2

About 4-(2-aminocyclohexanecarbonyl)-N-ethylpiperazine-1-carboxamide

4-(2-aminocyclohexanecarbonyl)-N-ethylpiperazine-1-carboxamide (PubChem CID 64825150) has the molecular formula C14H26N4O2 and a molecular weight of 282.39 g/mol. Its IUPAC name is 4-(2-aminocyclohexanecarbonyl)-N-ethylpiperazine-1-carboxamide.

Molecular Properties

Compound Name4-(2-aminocyclohexanecarbonyl)-N-ethylpiperazine-1-carboxamide
PubChem CID64825150
Molecular FormulaC14H26N4O2
Molecular Weight282.39 g/mol
Exact Mass282.21
IUPAC Name4-(2-aminocyclohexanecarbonyl)-N-ethylpiperazine-1-carboxamide
SMILESCCNC(=O)N1CCN(C(=O)C2CCCCC2N)CC1
InChIInChI=1S/C14H26N4O2/c1-2-16-14(20)18-9-7-17(8-10-18)13(19)11-5-3-4-6-12(11)15/h11-12H,2-10,15H2,1H3,(H,16,20)
InChIKeyKEPDLWVLRBFIOC-UHFFFAOYSA-N
XLogP0.38
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-aminocyclohexanecarbonyl)-N-ethylpiperidine-4-carboxamide
CID 64822823
N-ethyl-4-(2-methylpyrrolidine-3-carbonyl)piperazine-1-carboxamide
CID 79389325
1-[4-(2-aminocyclopentanecarbonyl)piperazin-1-yl]ethanone;hydrochloride
CID 119399085
(2-aminocyclohexyl)-(3-ethyl-4-methylpiperazin-1-yl)methanone
CID 55215394
2-[4-(ethylcarbamoyl)piperazine-1-carbonyl]cyclopropane-1-carboxylic acid
CID 60953640
(2-aminocyclopentyl)-(4-ethylpiperidin-1-yl)methanone
CID 64823610
(2-aminocyclohexyl)-(4-hydroxypiperidin-1-yl)methanone
CID 62776127
(2-aminocyclopentyl)-(4-tert-butylpiperazin-1-yl)methanone
CID 64823652
1-[4-(2-aminocyclopentanecarbonyl)piperazin-1-yl]-2-(dimethylamino)ethanone
CID 64823213
2-[1-(2-aminocyclohexanecarbonyl)piperidin-4-yl]acetic acid
CID 79615083
(2-aminocyclopentyl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone
CID 64823507
(2-aminocycloheptyl)-(1,1-dioxo-1,4-thiazepan-4-yl)methanone
CID 103810965

Frequently Asked Questions

What is the IUPAC name of 4-(2-aminocyclohexanecarbonyl)-N-ethylpiperazine-1-carboxamide?
The IUPAC name of 4-(2-aminocyclohexanecarbonyl)-N-ethylpiperazine-1-carboxamide (CID 64825150) is 4-(2-aminocyclohexanecarbonyl)-N-ethylpiperazine-1-carboxamide.
What is the SMILES notation for 4-(2-aminocyclohexanecarbonyl)-N-ethylpiperazine-1-carboxamide?
The canonical SMILES for 4-(2-aminocyclohexanecarbonyl)-N-ethylpiperazine-1-carboxamide is CCNC(=O)N1CCN(C(=O)C2CCCCC2N)CC1.
What is the InChIKey of 4-(2-aminocyclohexanecarbonyl)-N-ethylpiperazine-1-carboxamide?
The InChIKey is KEPDLWVLRBFIOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O2/c1-2-16-14(20)18-9-7-17(8-10-18)13(19)11-5-3-4-6-12(11)15/h11-12H,2-10,15H2,1H3,(H,16,20).
What are the key properties of 4-(2-aminocyclohexanecarbonyl)-N-ethylpiperazine-1-carboxamide?
4-(2-aminocyclohexanecarbonyl)-N-ethylpiperazine-1-carboxamide has a molecular weight of 282.39 g/mol, XLogP of 0.38, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminocyclohexanecarbonyl)-N-ethylpiperazine-1-carboxamide is sourced from PubChem (CID 64825150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).