N-[4-(methylamino)phenyl]-4-propylpiperazine-1-carboxamide

C15H24N4O — CID 59608963

IUPACN-[4-(methylamino)phenyl]-4-propylpiperazine-1-carboxamide
SMILESCCCN1CCN(C(=O)Nc2ccc(NC)cc2)CC1
InChIInChI=1S/C15H24N4O/c1-3-8-18-9-11-19(12-10-18)15(20)17-14-6-4-13(16-2)5-7-14/h4-7,16H,3,8-12H2,1-2H3,(H,17,20)
InChIKeyZJAZUONWFZRSBP-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.29
Rot. Bonds4

About N-[4-(methylamino)phenyl]-4-propylpiperazine-1-carboxamide

N-[4-(methylamino)phenyl]-4-propylpiperazine-1-carboxamide (PubChem CID 59608963) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is N-[4-(methylamino)phenyl]-4-propylpiperazine-1-carboxamide.

Molecular Properties

Compound NameN-[4-(methylamino)phenyl]-4-propylpiperazine-1-carboxamide
PubChem CID59608963
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC NameN-[4-(methylamino)phenyl]-4-propylpiperazine-1-carboxamide
SMILESCCCN1CCN(C(=O)Nc2ccc(NC)cc2)CC1
InChIInChI=1S/C15H24N4O/c1-3-8-18-9-11-19(12-10-18)15(20)17-14-6-4-13(16-2)5-7-14/h4-7,16H,3,8-12H2,1-2H3,(H,17,20)
InChIKeyZJAZUONWFZRSBP-UHFFFAOYSA-N
XLogP2.29
TPSA47.61 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-phenyl-4-propylpiperazine-1-carboxamide
CID 17383007
N-(4-methylphenyl)-4-pentylpiperazine-1-carboxamide
CID 17184975
N-(4-cyanophenyl)-4-pentylpiperazine-1-carboxamide
CID 113110843
4-butyl-N-(4-pyrrolidin-1-ylphenyl)piperazine-1-carboxamide
CID 113103823
N-[4-(dimethylamino)phenyl]-4-ethylpiperazine-1-carboxamide
CID 108894833
4-(2-aminoethyl)-N-[4-(dimethylamino)phenyl]piperazine-1-carboxamide
CID 108894759
N-(4-ethylphenyl)-4-(2-methoxyethyl)piperazine-1-carboxamide
CID 113104950
ethyl 4-[(4-pentylpiperazine-1-carbonyl)amino]benzoate
CID 17185017
N-(4-fluorophenyl)-4-(2-hydroxyethyl)piperazine-1-carboxamide
CID 3030092
N-(4-tert-butylphenyl)-4-ethylpiperazine-1-carboxamide
CID 108884847
4-[[4-(2-hydroxyethyl)piperazine-1-carbonyl]amino]benzoic acid
CID 61202930
N-[4-(diethylamino)phenyl]-4-(3-methoxypropyl)piperazine-1-carboxamide
CID 113105254

Frequently Asked Questions

What is the IUPAC name of N-[4-(methylamino)phenyl]-4-propylpiperazine-1-carboxamide?
The IUPAC name of N-[4-(methylamino)phenyl]-4-propylpiperazine-1-carboxamide (CID 59608963) is N-[4-(methylamino)phenyl]-4-propylpiperazine-1-carboxamide.
What is the SMILES notation for N-[4-(methylamino)phenyl]-4-propylpiperazine-1-carboxamide?
The canonical SMILES for N-[4-(methylamino)phenyl]-4-propylpiperazine-1-carboxamide is CCCN1CCN(C(=O)Nc2ccc(NC)cc2)CC1.
What is the InChIKey of N-[4-(methylamino)phenyl]-4-propylpiperazine-1-carboxamide?
The InChIKey is ZJAZUONWFZRSBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-3-8-18-9-11-19(12-10-18)15(20)17-14-6-4-13(16-2)5-7-14/h4-7,16H,3,8-12H2,1-2H3,(H,17,20).
What are the key properties of N-[4-(methylamino)phenyl]-4-propylpiperazine-1-carboxamide?
N-[4-(methylamino)phenyl]-4-propylpiperazine-1-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.29, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(methylamino)phenyl]-4-propylpiperazine-1-carboxamide is sourced from PubChem (CID 59608963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).