N'-[2-(2-piperidin-1-ylethoxy)quinolin-6-yl]butanediamide

C20H26N4O3 — CID 151573426

IUPACN'-[2-(2-piperidin-1-ylethoxy)quinolin-6-yl]butanediamide
SMILESNC(=O)CCC(=O)Nc1ccc2nc(OCCN3CCCCC3)ccc2c1
InChIInChI=1S/C20H26N4O3/c21-18(25)7-8-19(26)22-16-5-6-17-15(14-16)4-9-20(23-17)27-13-12-24-10-2-1-3-11-24/h4-6,9,14H,1-3,7-8,10-13H2,(H2,21,25)(H,22,26)
InChIKeyQEYCGLNYXOQNIE-UHFFFAOYSA-N
MW370.45 g/mol
LogP2.30
Rot. Bonds8

About N'-[2-(2-piperidin-1-ylethoxy)quinolin-6-yl]butanediamide

N'-[2-(2-piperidin-1-ylethoxy)quinolin-6-yl]butanediamide (PubChem CID 151573426) has the molecular formula C20H26N4O3 and a molecular weight of 370.45 g/mol. Its IUPAC name is N'-[2-(2-piperidin-1-ylethoxy)quinolin-6-yl]butanediamide.

Molecular Properties

Compound NameN'-[2-(2-piperidin-1-ylethoxy)quinolin-6-yl]butanediamide
PubChem CID151573426
Molecular FormulaC20H26N4O3
Molecular Weight370.45 g/mol
Exact Mass370.20
IUPAC NameN'-[2-(2-piperidin-1-ylethoxy)quinolin-6-yl]butanediamide
SMILESNC(=O)CCC(=O)Nc1ccc2nc(OCCN3CCCCC3)ccc2c1
InChIInChI=1S/C20H26N4O3/c21-18(25)7-8-19(26)22-16-5-6-17-15(14-16)4-9-20(23-17)27-13-12-24-10-2-1-3-11-24/h4-6,9,14H,1-3,7-8,10-13H2,(H2,21,25)(H,22,26)
InChIKeyQEYCGLNYXOQNIE-UHFFFAOYSA-N
XLogP2.30
TPSA97.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-piperidin-1-ylethoxy)quinolin-6-amine
CID 61104220
2-(3-pyrrolidin-1-ylpropoxy)quinoline-6-carboxylic acid;hydrochloride
CID 122585506
4-amino-N-[3-methyl-4-(2-pyrrolidin-1-ylethoxy)phenyl]butanamide;dihydrochloride
CID 119889617
3-(azepan-1-yl)-N-(3,4-dimethoxyphenyl)propanamide
CID 109033634
N-[2-[2-(dimethylamino)ethoxy]quinolin-6-yl]acetamide
CID 45273437
N-[2-amino-6-(2-piperidin-1-ylethoxy)-3-pyridinyl]-4-chlorocyclohexane-1-carboxamide
CID 110178520
N-(1-chloroisoquinolin-7-yl)-4-piperidin-1-ylbutanamide
CID 169148179
N-[9-methyl-6-(3-pyrrolidin-1-ylpropanoylamino)acridin-3-yl]-3-pyrrolidin-1-ylpropanamide
CID 59868948
N-(3,4-dimethylphenyl)-3-piperidin-1-ylpropanamide
CID 771569
N-[9-(cycloheptylamino)-6-(3-pyrrolidin-1-ylpropanoylamino)acridin-3-yl]-3-pyrrolidin-1-ylpropanamide
CID 10120705
4-(3-pyrrolidin-1-ylpropanoylamino)benzamide
CID 110688218
2-(3-pyrrolidin-1-ylpropoxy)quinoline
CID 141047527

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2-piperidin-1-ylethoxy)quinolin-6-yl]butanediamide?
The IUPAC name of N'-[2-(2-piperidin-1-ylethoxy)quinolin-6-yl]butanediamide (CID 151573426) is N'-[2-(2-piperidin-1-ylethoxy)quinolin-6-yl]butanediamide.
What is the SMILES notation for N'-[2-(2-piperidin-1-ylethoxy)quinolin-6-yl]butanediamide?
The canonical SMILES for N'-[2-(2-piperidin-1-ylethoxy)quinolin-6-yl]butanediamide is NC(=O)CCC(=O)Nc1ccc2nc(OCCN3CCCCC3)ccc2c1.
What is the InChIKey of N'-[2-(2-piperidin-1-ylethoxy)quinolin-6-yl]butanediamide?
The InChIKey is QEYCGLNYXOQNIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O3/c21-18(25)7-8-19(26)22-16-5-6-17-15(14-16)4-9-20(23-17)27-13-12-24-10-2-1-3-11-24/h4-6,9,14H,1-3,7-8,10-13H2,(H2,21,25)(H,22,26).
What are the key properties of N'-[2-(2-piperidin-1-ylethoxy)quinolin-6-yl]butanediamide?
N'-[2-(2-piperidin-1-ylethoxy)quinolin-6-yl]butanediamide has a molecular weight of 370.45 g/mol, XLogP of 2.30, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2-piperidin-1-ylethoxy)quinolin-6-yl]butanediamide is sourced from PubChem (CID 151573426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).