[4-(ethylamino)piperidin-1-yl]-quinolin-8-ylmethanone

C17H21N3O — CID 62851096

IUPAC[4-(ethylamino)piperidin-1-yl]-quinolin-8-ylmethanone
SMILESCCNC1CCN(C(=O)c2cccc3cccnc23)CC1
InChIInChI=1S/C17H21N3O/c1-2-18-14-8-11-20(12-9-14)17(21)15-7-3-5-13-6-4-10-19-16(13)15/h3-7,10,14,18H,2,8-9,11-12H2,1H3
InChIKeyQOMNJQNCOJCSMO-UHFFFAOYSA-N
MW283.38 g/mol
LogP2.45
Rot. Bonds3

About [4-(ethylamino)piperidin-1-yl]-quinolin-8-ylmethanone

[4-(ethylamino)piperidin-1-yl]-quinolin-8-ylmethanone (PubChem CID 62851096) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is [4-(ethylamino)piperidin-1-yl]-quinolin-8-ylmethanone.

Molecular Properties

Compound Name[4-(ethylamino)piperidin-1-yl]-quinolin-8-ylmethanone
PubChem CID62851096
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC Name[4-(ethylamino)piperidin-1-yl]-quinolin-8-ylmethanone
SMILESCCNC1CCN(C(=O)c2cccc3cccnc23)CC1
InChIInChI=1S/C17H21N3O/c1-2-18-14-8-11-20(12-9-14)17(21)15-7-3-5-13-6-4-10-19-16(13)15/h3-7,10,14,18H,2,8-9,11-12H2,1H3
InChIKeyQOMNJQNCOJCSMO-UHFFFAOYSA-N
XLogP2.45
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(methylamino)piperidin-1-yl]-quinolin-8-ylmethanone;dihydrochloride
CID 119562051
[4-(ethylaminomethyl)piperidin-1-yl]-quinolin-8-ylmethanone
CID 119646450
(4-aminopiperidin-1-yl)-quinolin-8-ylmethanone;dihydrochloride
CID 119375001
[3-(1-hydroxyethyl)pyrrolidin-1-yl]-quinolin-8-ylmethanone
CID 115966148
(3-hydroxypyrrolidin-1-yl)-quinolin-8-ylmethanone
CID 62917957
[3-(aminomethyl)-4-methylpiperidin-1-yl]-quinolin-8-ylmethanone
CID 114960494
N-[2-(cyclopropylamino)ethyl]quinoline-8-carboxamide
CID 55126983
(3-hydroxypiperidin-1-yl)-quinolin-8-ylmethanone
CID 43415800
[4-(ethylamino)piperidin-1-yl]-(3-fluoro-4-pyridinyl)methanone
CID 64950641
2-[(3S)-1-(quinoline-8-carbonyl)pyrrolidin-3-yl]benzoic acid
CID 95725546
(2,6-difluorophenyl)-[4-(ethylamino)piperidin-1-yl]methanone
CID 54923672
(3,5-dimethylpiperazin-1-yl)-quinolin-8-ylmethanone;dihydrochloride
CID 119564484

Frequently Asked Questions

What is the IUPAC name of [4-(ethylamino)piperidin-1-yl]-quinolin-8-ylmethanone?
The IUPAC name of [4-(ethylamino)piperidin-1-yl]-quinolin-8-ylmethanone (CID 62851096) is [4-(ethylamino)piperidin-1-yl]-quinolin-8-ylmethanone.
What is the SMILES notation for [4-(ethylamino)piperidin-1-yl]-quinolin-8-ylmethanone?
The canonical SMILES for [4-(ethylamino)piperidin-1-yl]-quinolin-8-ylmethanone is CCNC1CCN(C(=O)c2cccc3cccnc23)CC1.
What is the InChIKey of [4-(ethylamino)piperidin-1-yl]-quinolin-8-ylmethanone?
The InChIKey is QOMNJQNCOJCSMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-2-18-14-8-11-20(12-9-14)17(21)15-7-3-5-13-6-4-10-19-16(13)15/h3-7,10,14,18H,2,8-9,11-12H2,1H3.
What are the key properties of [4-(ethylamino)piperidin-1-yl]-quinolin-8-ylmethanone?
[4-(ethylamino)piperidin-1-yl]-quinolin-8-ylmethanone has a molecular weight of 283.38 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(ethylamino)piperidin-1-yl]-quinolin-8-ylmethanone is sourced from PubChem (CID 62851096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).