4-cyclopropyl-N-(4-methoxyphenyl)piperazine-1-carboxamide

C15H21N3O2 — CID 47455403

IUPAC4-cyclopropyl-N-(4-methoxyphenyl)piperazine-1-carboxamide
SMILESCOc1ccc(NC(=O)N2CCN(C3CC3)CC2)cc1
InChIInChI=1S/C15H21N3O2/c1-20-14-6-2-12(3-7-14)16-15(19)18-10-8-17(9-11-18)13-4-5-13/h2-3,6-7,13H,4-5,8-11H2,1H3,(H,16,19)
InChIKeyFDULGXJXAWRAOV-UHFFFAOYSA-N
MW275.35 g/mol
LogP2.01
Rot. Bonds3

About 4-cyclopropyl-N-(4-methoxyphenyl)piperazine-1-carboxamide

4-cyclopropyl-N-(4-methoxyphenyl)piperazine-1-carboxamide (PubChem CID 47455403) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 4-cyclopropyl-N-(4-methoxyphenyl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-cyclopropyl-N-(4-methoxyphenyl)piperazine-1-carboxamide
PubChem CID47455403
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name4-cyclopropyl-N-(4-methoxyphenyl)piperazine-1-carboxamide
SMILESCOc1ccc(NC(=O)N2CCN(C3CC3)CC2)cc1
InChIInChI=1S/C15H21N3O2/c1-20-14-6-2-12(3-7-14)16-15(19)18-10-8-17(9-11-18)13-4-5-13/h2-3,6-7,13H,4-5,8-11H2,1H3,(H,16,19)
InChIKeyFDULGXJXAWRAOV-UHFFFAOYSA-N
XLogP2.01
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-4-cyclopropylpiperazine-1-carboxamide
CID 113103473
4-cyclopropyl-N-(4-methylphenyl)piperazine-1-carboxamide
CID 47455397
4-cyclopentyl-N-(3,5-dimethoxyphenyl)piperazine-1-carboxamide
CID 86986929
N-(4-methoxyphenyl)-4-(triazol-2-yl)piperidine-1-carboxamide
CID 121165118
methyl 4-[(4-cyclohexylpiperazine-1-carbonyl)amino]benzoate
CID 113104639
1-N-(4-methoxyphenyl)-4-N-methyl-1,4-diazepane-1,4-dicarboxamide
CID 23800038
4-(methoxymethyl)-N-(4-methoxyphenyl)piperidine-1-carboxamide
CID 121091713
4-cyclopropyl-N-[2-(4-methoxyphenyl)ethyl]piperazine-1-carboxamide
CID 113103421
N-(4-hydroxyphenyl)-4-(4-methoxyphenyl)piperidine-1-carboxamide
CID 71166547
4-(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-N-(4-methoxyphenyl)piperidine-1-carboxamide
CID 69451741
N-(4-aminophenyl)-4-cyclopentylpiperazine-1-carboxamide
CID 62369641
N-(4-bromophenyl)-4-cyclopentylpiperazine-1-carboxamide
CID 17185073

Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-N-(4-methoxyphenyl)piperazine-1-carboxamide?
The IUPAC name of 4-cyclopropyl-N-(4-methoxyphenyl)piperazine-1-carboxamide (CID 47455403) is 4-cyclopropyl-N-(4-methoxyphenyl)piperazine-1-carboxamide.
What is the SMILES notation for 4-cyclopropyl-N-(4-methoxyphenyl)piperazine-1-carboxamide?
The canonical SMILES for 4-cyclopropyl-N-(4-methoxyphenyl)piperazine-1-carboxamide is COc1ccc(NC(=O)N2CCN(C3CC3)CC2)cc1.
What is the InChIKey of 4-cyclopropyl-N-(4-methoxyphenyl)piperazine-1-carboxamide?
The InChIKey is FDULGXJXAWRAOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-20-14-6-2-12(3-7-14)16-15(19)18-10-8-17(9-11-18)13-4-5-13/h2-3,6-7,13H,4-5,8-11H2,1H3,(H,16,19).
What are the key properties of 4-cyclopropyl-N-(4-methoxyphenyl)piperazine-1-carboxamide?
4-cyclopropyl-N-(4-methoxyphenyl)piperazine-1-carboxamide has a molecular weight of 275.35 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-N-(4-methoxyphenyl)piperazine-1-carboxamide is sourced from PubChem (CID 47455403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).