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

C17H20N4O — CID 113103496

IUPAC4-cyclopropyl-N-quinolin-8-ylpiperazine-1-carboxamide
SMILESO=C(Nc1cccc2cccnc12)N1CCN(C2CC2)CC1
InChIInChI=1S/C17H20N4O/c22-17(21-11-9-20(10-12-21)14-6-7-14)19-15-5-1-3-13-4-2-8-18-16(13)15/h1-5,8,14H,6-7,9-12H2,(H,19,22)
InChIKeyWPGPTGIMFHAMCY-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.55
Rot. Bonds2

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

4-cyclopropyl-N-quinolin-8-ylpiperazine-1-carboxamide (PubChem CID 113103496) has the molecular formula C17H20N4O and a molecular weight of 296.37 g/mol. Its IUPAC name is 4-cyclopropyl-N-quinolin-8-ylpiperazine-1-carboxamide.

Molecular Properties

Compound Name4-cyclopropyl-N-quinolin-8-ylpiperazine-1-carboxamide
PubChem CID113103496
Molecular FormulaC17H20N4O
Molecular Weight296.37 g/mol
Exact Mass296.16
IUPAC Name4-cyclopropyl-N-quinolin-8-ylpiperazine-1-carboxamide
SMILESO=C(Nc1cccc2cccnc12)N1CCN(C2CC2)CC1
InChIInChI=1S/C17H20N4O/c22-17(21-11-9-20(10-12-21)14-6-7-14)19-15-5-1-3-13-4-2-8-18-16(13)15/h1-5,8,14H,6-7,9-12H2,(H,19,22)
InChIKeyWPGPTGIMFHAMCY-UHFFFAOYSA-N
XLogP2.55
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-cyclopropylpiperidin-4-yl)-N-quinolin-8-ylacetamide
CID 110754868
4-acetamido-N-quinolin-8-ylpiperidine-1-carboxamide
CID 49468374
4-cyclopropyl-N-naphthalen-1-ylpiperazine-1-carboxamide
CID 51096006
4-(cyclohexanecarbonylamino)-N-quinolin-8-ylpiperidine-1-carboxamide
CID 127145528
4-(3-methylbutyl)-N-quinolin-8-ylpiperazine-1-carboxamide
CID 48782141
4-[(4-methylphenyl)methyl]-N-quinolin-8-ylpiperazine-1-carboxamide
CID 113107085
4-[4-(dimethylamino)phenyl]-N-quinolin-8-ylpiperazine-1-carboxamide
CID 113114415
4-(3-acetylphenyl)-N-quinolin-8-ylpiperazine-1-carboxamide
CID 113114157
3-(cyclopropylmethoxy)-N-quinolin-8-ylpyrrolidine-1-carboxamide
CID 121022748
N-(2-bromophenyl)-4-cyclopropylpiperazine-1-carboxamide
CID 113103489
(2S)-2-cyclopentyl-N-quinolin-8-ylpyrrolidine-1-carboxamide
CID 94652787
4-(3,4-dimethoxybenzoyl)-N-quinolin-8-ylpiperazine-1-carboxamide
CID 55695804

Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-N-quinolin-8-ylpiperazine-1-carboxamide?
The IUPAC name of 4-cyclopropyl-N-quinolin-8-ylpiperazine-1-carboxamide (CID 113103496) is 4-cyclopropyl-N-quinolin-8-ylpiperazine-1-carboxamide.
What is the SMILES notation for 4-cyclopropyl-N-quinolin-8-ylpiperazine-1-carboxamide?
The canonical SMILES for 4-cyclopropyl-N-quinolin-8-ylpiperazine-1-carboxamide is O=C(Nc1cccc2cccnc12)N1CCN(C2CC2)CC1.
What is the InChIKey of 4-cyclopropyl-N-quinolin-8-ylpiperazine-1-carboxamide?
The InChIKey is WPGPTGIMFHAMCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O/c22-17(21-11-9-20(10-12-21)14-6-7-14)19-15-5-1-3-13-4-2-8-18-16(13)15/h1-5,8,14H,6-7,9-12H2,(H,19,22).
What are the key properties of 4-cyclopropyl-N-quinolin-8-ylpiperazine-1-carboxamide?
4-cyclopropyl-N-quinolin-8-ylpiperazine-1-carboxamide has a molecular weight of 296.37 g/mol, XLogP of 2.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-N-quinolin-8-ylpiperazine-1-carboxamide is sourced from PubChem (CID 113103496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).