N-[4-(4-cyclopropylpiperazine-1-carbonyl)phenyl]acetamide

C16H21N3O2 — CID 110741243

IUPACN-[4-(4-cyclopropylpiperazine-1-carbonyl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(C(=O)N2CCN(C3CC3)CC2)cc1
InChIInChI=1S/C16H21N3O2/c1-12(20)17-14-4-2-13(3-5-14)16(21)19-10-8-18(9-11-19)15-6-7-15/h2-5,15H,6-11H2,1H3,(H,17,20)
InChIKeyDXGHGYVYGGLGBO-UHFFFAOYSA-N
MW287.36 g/mol
LogP1.57
Rot. Bonds3

About N-[4-(4-cyclopropylpiperazine-1-carbonyl)phenyl]acetamide

N-[4-(4-cyclopropylpiperazine-1-carbonyl)phenyl]acetamide (PubChem CID 110741243) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is N-[4-(4-cyclopropylpiperazine-1-carbonyl)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-(4-cyclopropylpiperazine-1-carbonyl)phenyl]acetamide
PubChem CID110741243
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC NameN-[4-(4-cyclopropylpiperazine-1-carbonyl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(C(=O)N2CCN(C3CC3)CC2)cc1
InChIInChI=1S/C16H21N3O2/c1-12(20)17-14-4-2-13(3-5-14)16(21)19-10-8-18(9-11-19)15-6-7-15/h2-5,15H,6-11H2,1H3,(H,17,20)
InChIKeyDXGHGYVYGGLGBO-UHFFFAOYSA-N
XLogP1.57
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-4-cyclopropylpiperazine-1-carboxamide
CID 113103473
(4-cyclopropylpiperazin-1-yl)-[4-(propylamino)phenyl]methanone
CID 62178193
N-[4-[4-(cyclopropanecarbonyl)-1,4-diazepane-1-carbonyl]phenyl]acetamide
CID 110806427
N-[4-[4-(2-methylpropanoyl)piperazine-1-carbonyl]phenyl]acetamide
CID 110800200
1-(4-acetamidobenzoyl)-N-methylpiperidine-4-carboxamide
CID 20973013
4-(4-acetamidobenzoyl)-N-cyclohexylpiperazine-1-carboxamide
CID 110812233
N-[4-(3-piperazin-1-ylpyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride
CID 120997852
N-[4-(3-hydroxypyrrolidine-1-carbonyl)phenyl]acetamide
CID 62918779
(4-cyclopropylpiperazin-1-yl)-[4-(1-hydroxy-2-methylpropyl)phenyl]methanone
CID 24781527
N-[4-[4-(methylaminomethyl)piperidine-1-carbonyl]phenyl]acetamide;hydrochloride
CID 119542570
N-[4-[4-(dimethylamino)azepane-1-carbonyl]phenyl]acetamide
CID 136536271
N-[4-(2-benzyl-4-cyclopropylpiperazine-1-carbonyl)phenyl]acetamide
CID 90567032

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-cyclopropylpiperazine-1-carbonyl)phenyl]acetamide?
The IUPAC name of N-[4-(4-cyclopropylpiperazine-1-carbonyl)phenyl]acetamide (CID 110741243) is N-[4-(4-cyclopropylpiperazine-1-carbonyl)phenyl]acetamide.
What is the SMILES notation for N-[4-(4-cyclopropylpiperazine-1-carbonyl)phenyl]acetamide?
The canonical SMILES for N-[4-(4-cyclopropylpiperazine-1-carbonyl)phenyl]acetamide is CC(=O)Nc1ccc(C(=O)N2CCN(C3CC3)CC2)cc1.
What is the InChIKey of N-[4-(4-cyclopropylpiperazine-1-carbonyl)phenyl]acetamide?
The InChIKey is DXGHGYVYGGLGBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-12(20)17-14-4-2-13(3-5-14)16(21)19-10-8-18(9-11-19)15-6-7-15/h2-5,15H,6-11H2,1H3,(H,17,20).
What are the key properties of N-[4-(4-cyclopropylpiperazine-1-carbonyl)phenyl]acetamide?
N-[4-(4-cyclopropylpiperazine-1-carbonyl)phenyl]acetamide has a molecular weight of 287.36 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-cyclopropylpiperazine-1-carbonyl)phenyl]acetamide is sourced from PubChem (CID 110741243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).