N-propyl-4-quinolin-8-ylpiperazine-1-carboxamide

C17H22N4O — CID 113103296

IUPACN-propyl-4-quinolin-8-ylpiperazine-1-carboxamide
SMILESCCCNC(=O)N1CCN(c2cccc3cccnc23)CC1
InChIInChI=1S/C17H22N4O/c1-2-8-19-17(22)21-12-10-20(11-13-21)15-7-3-5-14-6-4-9-18-16(14)15/h3-7,9H,2,8,10-13H2,1H3,(H,19,22)
InChIKeyQUUWMYZQTWVDKM-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.48
Rot. Bonds3

About N-propyl-4-quinolin-8-ylpiperazine-1-carboxamide

N-propyl-4-quinolin-8-ylpiperazine-1-carboxamide (PubChem CID 113103296) has the molecular formula C17H22N4O and a molecular weight of 298.39 g/mol. Its IUPAC name is N-propyl-4-quinolin-8-ylpiperazine-1-carboxamide.

Molecular Properties

Compound NameN-propyl-4-quinolin-8-ylpiperazine-1-carboxamide
PubChem CID113103296
Molecular FormulaC17H22N4O
Molecular Weight298.39 g/mol
Exact Mass298.18
IUPAC NameN-propyl-4-quinolin-8-ylpiperazine-1-carboxamide
SMILESCCCNC(=O)N1CCN(c2cccc3cccnc23)CC1
InChIInChI=1S/C17H22N4O/c1-2-8-19-17(22)21-12-10-20(11-13-21)15-7-3-5-14-6-4-9-18-16(14)15/h3-7,9H,2,8,10-13H2,1H3,(H,19,22)
InChIKeyQUUWMYZQTWVDKM-UHFFFAOYSA-N
XLogP2.48
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methylpropyl)-4-quinolin-8-ylpiperazine-1-carboxamide
CID 113104125
1-(4-quinolin-8-ylpiperazin-1-yl)propan-1-one
CID 113079712
N-[(4-chlorophenyl)methyl]-4-quinolin-8-ylpiperazine-1-carboxamide
CID 113107984
N-(4-ethylphenyl)-4-quinolin-8-ylpiperazine-1-carboxamide
CID 113112168
N-cycloheptyl-4-quinolin-8-ylpiperazine-1-carboxamide
CID 113110634
N-(1-phenylethyl)-4-quinolin-8-ylpiperazine-1-carboxamide
CID 113107350
8-(4-methylpiperazin-1-yl)quinoline
CID 20701166
N-(2,4-dimethylphenyl)-4-quinolin-8-ylpiperazine-1-carboxamide
CID 113111498
8-(4-pentylpiperazin-1-yl)quinoline
CID 20649338
N-propyl-4-pyridin-4-ylpiperazine-1-carboxamide
CID 47117590
(4-methoxyphenyl)-(4-quinolin-8-ylpiperazin-1-yl)methanone
CID 113079735
4-phenyl-N-propylpiperazine-1-carboxamide
CID 4597533

Frequently Asked Questions

What is the IUPAC name of N-propyl-4-quinolin-8-ylpiperazine-1-carboxamide?
The IUPAC name of N-propyl-4-quinolin-8-ylpiperazine-1-carboxamide (CID 113103296) is N-propyl-4-quinolin-8-ylpiperazine-1-carboxamide.
What is the SMILES notation for N-propyl-4-quinolin-8-ylpiperazine-1-carboxamide?
The canonical SMILES for N-propyl-4-quinolin-8-ylpiperazine-1-carboxamide is CCCNC(=O)N1CCN(c2cccc3cccnc23)CC1.
What is the InChIKey of N-propyl-4-quinolin-8-ylpiperazine-1-carboxamide?
The InChIKey is QUUWMYZQTWVDKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O/c1-2-8-19-17(22)21-12-10-20(11-13-21)15-7-3-5-14-6-4-9-18-16(14)15/h3-7,9H,2,8,10-13H2,1H3,(H,19,22).
What are the key properties of N-propyl-4-quinolin-8-ylpiperazine-1-carboxamide?
N-propyl-4-quinolin-8-ylpiperazine-1-carboxamide has a molecular weight of 298.39 g/mol, XLogP of 2.48, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-4-quinolin-8-ylpiperazine-1-carboxamide is sourced from PubChem (CID 113103296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).