4-cyclobutylpiperazine-1-carboxamide

C9H17N3O — CID 53426578

IUPAC4-cyclobutylpiperazine-1-carboxamide
SMILESNC(=O)N1CCN(C2CCC2)CC1
InChIInChI=1S/C9H17N3O/c10-9(13)12-6-4-11(5-7-12)8-2-1-3-8/h8H,1-7H2,(H2,10,13)
InChIKeyOTMNXIWTCOLYCD-UHFFFAOYSA-N
MW183.25 g/mol
LogP0.24
Rot. Bonds1

About 4-cyclobutylpiperazine-1-carboxamide

4-cyclobutylpiperazine-1-carboxamide (PubChem CID 53426578) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is 4-cyclobutylpiperazine-1-carboxamide.

Molecular Properties

Compound Name4-cyclobutylpiperazine-1-carboxamide
PubChem CID53426578
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC Name4-cyclobutylpiperazine-1-carboxamide
SMILESNC(=O)N1CCN(C2CCC2)CC1
InChIInChI=1S/C9H17N3O/c10-9(13)12-6-4-11(5-7-12)8-2-1-3-8/h8H,1-7H2,(H2,10,13)
InChIKeyOTMNXIWTCOLYCD-UHFFFAOYSA-N
XLogP0.24
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-cyclopentylpiperazine-1-carboxamide
CID 57205906
ethane;4-(1-methylpiperidin-4-yl)piperazine-1-carboxamide
CID 143900234
1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboxamide
CID 78942270
4-[(1-cyclopropylpiperidin-4-yl)amino]piperidine-1-carboxamide
CID 43791337
1-(4-cyclobutylpiperazin-1-yl)prop-2-en-1-one
CID 130842439
1-(4-cyclopentylpiperazin-1-yl)ethanone;ethane
CID 143413632
cyclobutyl-(4-cycloheptylpiperazin-1-yl)methanone
CID 113074947
[4-(4-cyclopentylpiperazine-1-carbonyl)cyclohexyl]-(4-cyclopentylpiperazin-1-yl)methanone
CID 112815528
2-(4-cyclobutylpiperazin-1-yl)acetamide;hydrochloride
CID 121020770
1,4-dicyclopentylpiperazine;oxalic acid
CID 17369822
4-amino-1-(4-cyclobutylpiperazin-1-yl)butan-1-one;dihydrochloride
CID 119887218
(3-aminocyclohexyl)-(4-cyclobutylpiperazin-1-yl)methanone;dihydrochloride
CID 119887153

Frequently Asked Questions

What is the IUPAC name of 4-cyclobutylpiperazine-1-carboxamide?
The IUPAC name of 4-cyclobutylpiperazine-1-carboxamide (CID 53426578) is 4-cyclobutylpiperazine-1-carboxamide.
What is the SMILES notation for 4-cyclobutylpiperazine-1-carboxamide?
The canonical SMILES for 4-cyclobutylpiperazine-1-carboxamide is NC(=O)N1CCN(C2CCC2)CC1.
What is the InChIKey of 4-cyclobutylpiperazine-1-carboxamide?
The InChIKey is OTMNXIWTCOLYCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O/c10-9(13)12-6-4-11(5-7-12)8-2-1-3-8/h8H,1-7H2,(H2,10,13).
What are the key properties of 4-cyclobutylpiperazine-1-carboxamide?
4-cyclobutylpiperazine-1-carboxamide has a molecular weight of 183.25 g/mol, XLogP of 0.24, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclobutylpiperazine-1-carboxamide is sourced from PubChem (CID 53426578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).