2-(4-acetylpiperazine-1-carbonyl)-N-propylcyclopropane-1-carboxamide

C14H23N3O3 — CID 109130438

IUPAC2-(4-acetylpiperazine-1-carbonyl)-N-propylcyclopropane-1-carboxamide
SMILESCCCNC(=O)C1CC1C(=O)N1CCN(C(C)=O)CC1
InChIInChI=1S/C14H23N3O3/c1-3-4-15-13(19)11-9-12(11)14(20)17-7-5-16(6-8-17)10(2)18/h11-12H,3-9H2,1-2H3,(H,15,19)
InChIKeyJGLRWFIEKQUTBU-UHFFFAOYSA-N
MW281.36 g/mol
LogP-0.16
Rot. Bonds4

About 2-(4-acetylpiperazine-1-carbonyl)-N-propylcyclopropane-1-carboxamide

2-(4-acetylpiperazine-1-carbonyl)-N-propylcyclopropane-1-carboxamide (PubChem CID 109130438) has the molecular formula C14H23N3O3 and a molecular weight of 281.36 g/mol. Its IUPAC name is 2-(4-acetylpiperazine-1-carbonyl)-N-propylcyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-(4-acetylpiperazine-1-carbonyl)-N-propylcyclopropane-1-carboxamide
PubChem CID109130438
Molecular FormulaC14H23N3O3
Molecular Weight281.36 g/mol
Exact Mass281.17
IUPAC Name2-(4-acetylpiperazine-1-carbonyl)-N-propylcyclopropane-1-carboxamide
SMILESCCCNC(=O)C1CC1C(=O)N1CCN(C(C)=O)CC1
InChIInChI=1S/C14H23N3O3/c1-3-4-15-13(19)11-9-12(11)14(20)17-7-5-16(6-8-17)10(2)18/h11-12H,3-9H2,1-2H3,(H,15,19)
InChIKeyJGLRWFIEKQUTBU-UHFFFAOYSA-N
XLogP-0.16
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 5-0.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-(dimethylamino)ethyl)-2-oxopiperidine-3-carboxamide
CID 3623770
3-[(2S,5S)-5-(2-methylpropyl)-3,6-dioxopiperazin-2-yl]propanamide
CID 57400085
1-(cyclopropanecarbonyl)-N-[2-(4-methylpiperidin-1-yl)ethyl]piperidine-4-carboxamide
CID 53501644
N-[2-(diethylamino)ethyl]piperidine-4-carboxamide
CID 16769085
4-Methyl-1-(piperazin-1-yl)pentan-1-one
CID 20596588
4-(4-Methylpentanoyl)piperazin-2-one
CID 40231374
1-(2-Methylcyclopropanecarbonyl)piperazine hydrochloride
CID 91641391
N-(cyclopropylmethyl)-1-(2-methylpropanoyl)piperidine-4-carboxamide
CID 47021855
N-cyclopropyl-2-[2-(2-methylpropyl)-3-oxopiperazin-1-yl]acetamide
CID 121515957
1-(2-Methylcyclopropanecarbonyl)piperazine
CID 16228148
1-Methyl-4-[(methylamino)methyl]piperidin-2-one
CID 83694709
1-(2-aminoacetyl)-N-methylpiperidine-4-carboxamide
CID 43579507

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetylpiperazine-1-carbonyl)-N-propylcyclopropane-1-carboxamide?
The IUPAC name of 2-(4-acetylpiperazine-1-carbonyl)-N-propylcyclopropane-1-carboxamide (CID 109130438) is 2-(4-acetylpiperazine-1-carbonyl)-N-propylcyclopropane-1-carboxamide.
What is the SMILES notation for 2-(4-acetylpiperazine-1-carbonyl)-N-propylcyclopropane-1-carboxamide?
The canonical SMILES for 2-(4-acetylpiperazine-1-carbonyl)-N-propylcyclopropane-1-carboxamide is CCCNC(=O)C1CC1C(=O)N1CCN(C(C)=O)CC1.
What is the InChIKey of 2-(4-acetylpiperazine-1-carbonyl)-N-propylcyclopropane-1-carboxamide?
The InChIKey is JGLRWFIEKQUTBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3/c1-3-4-15-13(19)11-9-12(11)14(20)17-7-5-16(6-8-17)10(2)18/h11-12H,3-9H2,1-2H3,(H,15,19).
What are the key properties of 2-(4-acetylpiperazine-1-carbonyl)-N-propylcyclopropane-1-carboxamide?
2-(4-acetylpiperazine-1-carbonyl)-N-propylcyclopropane-1-carboxamide has a molecular weight of 281.36 g/mol, XLogP of -0.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetylpiperazine-1-carbonyl)-N-propylcyclopropane-1-carboxamide is sourced from PubChem (CID 109130438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).