N-methyl-N-(4-propylphenyl)piperazine-1-carboxamide

C15H23N3O — CID 115171520

IUPACN-methyl-N-(4-propylphenyl)piperazine-1-carboxamide
SMILESCCCc1ccc(N(C)C(=O)N2CCNCC2)cc1
InChIInChI=1S/C15H23N3O/c1-3-4-13-5-7-14(8-6-13)17(2)15(19)18-11-9-16-10-12-18/h5-8,16H,3-4,9-12H2,1-2H3
InChIKeyGRAYYXMAFWFNNE-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.10
Rot. Bonds3

About N-methyl-N-(4-propylphenyl)piperazine-1-carboxamide

N-methyl-N-(4-propylphenyl)piperazine-1-carboxamide (PubChem CID 115171520) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-methyl-N-(4-propylphenyl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(4-propylphenyl)piperazine-1-carboxamide
PubChem CID115171520
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-methyl-N-(4-propylphenyl)piperazine-1-carboxamide
SMILESCCCc1ccc(N(C)C(=O)N2CCNCC2)cc1
InChIInChI=1S/C15H23N3O/c1-3-4-13-5-7-14(8-6-13)17(2)15(19)18-11-9-16-10-12-18/h5-8,16H,3-4,9-12H2,1-2H3
InChIKeyGRAYYXMAFWFNNE-UHFFFAOYSA-N
XLogP2.10
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-chlorophenyl)-N-methylpiperazine-1-carboxamide
CID 115171510
methyl-(4-propylphenyl)carbamic acid
CID 115170704
N-methyl-N-(4-propylphenyl)-2-pyrrolidin-3-ylacetamide
CID 115160309
2-(4-butylphenyl)-1-piperazin-1-ylethanone;hydrochloride
CID 119403589
N-methyl-N-(4-propylphenyl)piperidine-3-carboxamide
CID 115159880
N-(2,3-dihydro-1-benzofuran-5-yl)-N-methylpiperazine-1-carboxamide
CID 115171539
N-(4-ethylphenyl)-N,2-dimethyl-2-piperazin-1-ylpropanamide
CID 80547263
4-[[methyl(piperazine-1-carbonyl)amino]methyl]benzoic acid
CID 61405190
3-[4-[methyl-[(2R)-2-methylpiperazine-1-carbonyl]amino]phenyl]propanoic acid
CID 170440463
4-(4-ethoxyphenyl)-2-methyl-1-piperazin-1-ylbutan-1-one
CID 83932209
1-[4-(4-propylphenyl)butan-2-yl]piperazine
CID 116931952
3-[4-(2-methylpropyl)phenyl]-1-piperazin-1-ylpropan-1-one
CID 95477399

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(4-propylphenyl)piperazine-1-carboxamide?
The IUPAC name of N-methyl-N-(4-propylphenyl)piperazine-1-carboxamide (CID 115171520) is N-methyl-N-(4-propylphenyl)piperazine-1-carboxamide.
What is the SMILES notation for N-methyl-N-(4-propylphenyl)piperazine-1-carboxamide?
The canonical SMILES for N-methyl-N-(4-propylphenyl)piperazine-1-carboxamide is CCCc1ccc(N(C)C(=O)N2CCNCC2)cc1.
What is the InChIKey of N-methyl-N-(4-propylphenyl)piperazine-1-carboxamide?
The InChIKey is GRAYYXMAFWFNNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-3-4-13-5-7-14(8-6-13)17(2)15(19)18-11-9-16-10-12-18/h5-8,16H,3-4,9-12H2,1-2H3.
What are the key properties of N-methyl-N-(4-propylphenyl)piperazine-1-carboxamide?
N-methyl-N-(4-propylphenyl)piperazine-1-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(4-propylphenyl)piperazine-1-carboxamide is sourced from PubChem (CID 115171520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).