N-[4-(dimethylamino)phenyl]-4-ethylpiperazine-1-carboxamide

C15H24N4O — CID 108894833

IUPACN-[4-(dimethylamino)phenyl]-4-ethylpiperazine-1-carboxamide
SMILESCCN1CCN(C(=O)Nc2ccc(N(C)C)cc2)CC1
InChIInChI=1S/C15H24N4O/c1-4-18-9-11-19(12-10-18)15(20)16-13-5-7-14(8-6-13)17(2)3/h5-8H,4,9-12H2,1-3H3,(H,16,20)
InChIKeyPSVAOURVBPBPCC-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.92
Rot. Bonds3

About N-[4-(dimethylamino)phenyl]-4-ethylpiperazine-1-carboxamide

N-[4-(dimethylamino)phenyl]-4-ethylpiperazine-1-carboxamide (PubChem CID 108894833) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is N-[4-(dimethylamino)phenyl]-4-ethylpiperazine-1-carboxamide.

Molecular Properties

Compound NameN-[4-(dimethylamino)phenyl]-4-ethylpiperazine-1-carboxamide
PubChem CID108894833
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC NameN-[4-(dimethylamino)phenyl]-4-ethylpiperazine-1-carboxamide
SMILESCCN1CCN(C(=O)Nc2ccc(N(C)C)cc2)CC1
InChIInChI=1S/C15H24N4O/c1-4-18-9-11-19(12-10-18)15(20)16-13-5-7-14(8-6-13)17(2)3/h5-8H,4,9-12H2,1-3H3,(H,16,20)
InChIKeyPSVAOURVBPBPCC-UHFFFAOYSA-N
XLogP1.92
TPSA38.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

4-(2-aminoethyl)-N-[4-(dimethylamino)phenyl]piperazine-1-carboxamide
CID 108894759
4-benzyl-N-[4-(dimethylamino)phenyl]piperazine-1-carboxamide
CID 108894755
N-(4-tert-butylphenyl)-4-ethylpiperazine-1-carboxamide
CID 108884847
N-[4-(dimethylamino)phenyl]-1-(4-ethylpiperazine-1-carbonyl)cyclopropane-1-carboxamide
CID 108974203
N-(3,4-dichlorophenyl)-4-ethylpiperazine-1-carboxamide
CID 1249136
1-N-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]-4-N-(4-fluorophenyl)piperazine-1,4-dicarboxamide
CID 175260722
N-[4-(dimethylamino)phenyl]-4-(3,5-dimethylphenyl)piperazine-1-carboxamide
CID 113111759
N-[4-(methylamino)phenyl]-4-propylpiperazine-1-carboxamide
CID 59608963
N-[4-(dimethylamino)phenyl]-4-[2-(3-methoxyphenyl)ethyl]piperazine-1-carboxamide
CID 113109409
N-(3,5-dihydroxyphenyl)-4-ethylpiperazine-1-carboxamide
CID 108895534
methyl 4-[[4-[4-(dimethylamino)phenyl]piperazine-1-carbonyl]amino]benzoate
CID 113114384
N-[4-(diethylamino)phenyl]-4-(3-methoxypropyl)piperazine-1-carboxamide
CID 113105254

Frequently Asked Questions

What is the IUPAC name of N-[4-(dimethylamino)phenyl]-4-ethylpiperazine-1-carboxamide?
The IUPAC name of N-[4-(dimethylamino)phenyl]-4-ethylpiperazine-1-carboxamide (CID 108894833) is N-[4-(dimethylamino)phenyl]-4-ethylpiperazine-1-carboxamide.
What is the SMILES notation for N-[4-(dimethylamino)phenyl]-4-ethylpiperazine-1-carboxamide?
The canonical SMILES for N-[4-(dimethylamino)phenyl]-4-ethylpiperazine-1-carboxamide is CCN1CCN(C(=O)Nc2ccc(N(C)C)cc2)CC1.
What is the InChIKey of N-[4-(dimethylamino)phenyl]-4-ethylpiperazine-1-carboxamide?
The InChIKey is PSVAOURVBPBPCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-4-18-9-11-19(12-10-18)15(20)16-13-5-7-14(8-6-13)17(2)3/h5-8H,4,9-12H2,1-3H3,(H,16,20).
What are the key properties of N-[4-(dimethylamino)phenyl]-4-ethylpiperazine-1-carboxamide?
N-[4-(dimethylamino)phenyl]-4-ethylpiperazine-1-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(dimethylamino)phenyl]-4-ethylpiperazine-1-carboxamide is sourced from PubChem (CID 108894833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).