2-[4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl]-N-quinolin-5-ylpropanamide

C20H27N5O2 — CID 42949605

IUPAC2-[4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl]-N-quinolin-5-ylpropanamide
SMILESCCNC(=O)CN1CCN(C(C)C(=O)Nc2cccc3ncccc23)CC1
InChIInChI=1S/C20H27N5O2/c1-3-21-19(26)14-24-10-12-25(13-11-24)15(2)20(27)23-18-8-4-7-17-16(18)6-5-9-22-17/h4-9,15H,3,10-14H2,1-2H3,(H,21,26)(H,23,27)
InChIKeyFNEWYHQHIPGGOL-UHFFFAOYSA-N
MW369.47 g/mol
LogP1.32
Rot. Bonds6

About 2-[4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl]-N-quinolin-5-ylpropanamide

2-[4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl]-N-quinolin-5-ylpropanamide (PubChem CID 42949605) has the molecular formula C20H27N5O2 and a molecular weight of 369.47 g/mol. Its IUPAC name is 2-[4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl]-N-quinolin-5-ylpropanamide.

Molecular Properties

Compound Name2-[4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl]-N-quinolin-5-ylpropanamide
PubChem CID42949605
Molecular FormulaC20H27N5O2
Molecular Weight369.47 g/mol
Exact Mass369.22
IUPAC Name2-[4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl]-N-quinolin-5-ylpropanamide
SMILESCCNC(=O)CN1CCN(C(C)C(=O)Nc2cccc3ncccc23)CC1
InChIInChI=1S/C20H27N5O2/c1-3-21-19(26)14-24-10-12-25(13-11-24)15(2)20(27)23-18-8-4-7-17-16(18)6-5-9-22-17/h4-9,15H,3,10-14H2,1-2H3,(H,21,26)(H,23,27)
InChIKeyFNEWYHQHIPGGOL-UHFFFAOYSA-N
XLogP1.32
TPSA77.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.47
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl]-N-quinolin-5-ylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-acetylpiperazin-1-yl)-N-quinolin-5-ylacetamide
CID 17428284
2-[4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl]-N-[2-(trifluoromethyl)phenyl]propanamide
CID 55565664
2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]-N-quinolin-5-ylpropanamide
CID 46527637
(2S)-2-[4-[2-(benzylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-methylphenyl)propanamide
CID 30637178
N-(3-chlorophenyl)-2-[4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl]propanamide
CID 55566269
2-[4-(3-methylbenzoyl)-1,4-diazepan-1-yl]-N-quinolin-5-ylpropanamide
CID 55565291
1-[(2R)-butan-2-yl]-3-quinolin-5-ylurea
CID 51928178
2-bromo-N-quinolin-5-ylpropanamide
CID 107902854
2-(4-benzyl-1,4-diazepan-1-yl)-N-quinolin-5-ylacetamide
CID 30297224
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-[4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl]propanamide
CID 55565860
2-[4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl]-N-(2,4,6-trimethylphenyl)propanamide
CID 86923497
(2S)-N-cyclopropyl-2-[4-[2-(2,3-dimethylanilino)-2-oxoethyl]piperazin-1-yl]propanamide
CID 8711915

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl]-N-quinolin-5-ylpropanamide?
The IUPAC name of 2-[4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl]-N-quinolin-5-ylpropanamide (CID 42949605) is 2-[4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl]-N-quinolin-5-ylpropanamide.
What is the SMILES notation for 2-[4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl]-N-quinolin-5-ylpropanamide?
The canonical SMILES for 2-[4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl]-N-quinolin-5-ylpropanamide is CCNC(=O)CN1CCN(C(C)C(=O)Nc2cccc3ncccc23)CC1.
What is the InChIKey of 2-[4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl]-N-quinolin-5-ylpropanamide?
The InChIKey is FNEWYHQHIPGGOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N5O2/c1-3-21-19(26)14-24-10-12-25(13-11-24)15(2)20(27)23-18-8-4-7-17-16(18)6-5-9-22-17/h4-9,15H,3,10-14H2,1-2H3,(H,21,26)(H,23,27).
What are the key properties of 2-[4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl]-N-quinolin-5-ylpropanamide?
2-[4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl]-N-quinolin-5-ylpropanamide has a molecular weight of 369.47 g/mol, XLogP of 1.32, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-(ethylamino)-2-oxoethyl]piperazin-1-yl]-N-quinolin-5-ylpropanamide is sourced from PubChem (CID 42949605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).