N-[2-(cyclopropylamino)-2-oxoethyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide

C15H19N3O2 — CID 62212757

IUPACN-[2-(cyclopropylamino)-2-oxoethyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide
SMILESO=C(CNC(=O)c1cccc2c1NCCC2)NC1CC1
InChIInChI=1S/C15H19N3O2/c19-13(18-11-6-7-11)9-17-15(20)12-5-1-3-10-4-2-8-16-14(10)12/h1,3,5,11,16H,2,4,6-9H2,(H,17,20)(H,18,19)
InChIKeyWOEJNGZZKSPIEX-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.05
Rot. Bonds4

About N-[2-(cyclopropylamino)-2-oxoethyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide

N-[2-(cyclopropylamino)-2-oxoethyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide (PubChem CID 62212757) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is N-[2-(cyclopropylamino)-2-oxoethyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide.

Molecular Properties

Compound NameN-[2-(cyclopropylamino)-2-oxoethyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide
PubChem CID62212757
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC NameN-[2-(cyclopropylamino)-2-oxoethyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide
SMILESO=C(CNC(=O)c1cccc2c1NCCC2)NC1CC1
InChIInChI=1S/C15H19N3O2/c19-13(18-11-6-7-11)9-17-15(20)12-5-1-3-10-4-2-8-16-14(10)12/h1,3,5,11,16H,2,4,6-9H2,(H,17,20)(H,18,19)
InChIKeyWOEJNGZZKSPIEX-UHFFFAOYSA-N
XLogP1.05
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-methylpiperidin-4-yl)-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 62214552
N-butyl-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 62213109
N-(2,3-dimethylbutyl)-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 64599539
N-methyl-1,2,3,4-tetrahydroquinoline-8-carboxamide;hydrochloride
CID 146675579
N-(3-ethylpentan-3-yl)-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 65041181
N-[3-(cyclopropylamino)-3-oxopropyl]-1,2,3,4-tetrahydroquinoxaline-5-carboxamide
CID 104615150
N-(1-azabicyclo[2.2.2]octan-3-yl)-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 62214906
N-[2-(3-methylbutoxy)ethyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 62215094
N-[[(3R)-1-methylsulfonylpiperidin-3-yl]methyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 125157866
formic acid;N-[(2R,3S,4S)-3-hydroxy-2-(hydroxymethyl)oxan-4-yl]-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 163334228
2-chloro-N-[2-(cyclohexylamino)-2-oxoethyl]benzamide
CID 4788216
N-[2-(cyclopentylamino)-2-oxoethyl]-2-methylbenzamide
CID 18106161

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylamino)-2-oxoethyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide?
The IUPAC name of N-[2-(cyclopropylamino)-2-oxoethyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide (CID 62212757) is N-[2-(cyclopropylamino)-2-oxoethyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide.
What is the SMILES notation for N-[2-(cyclopropylamino)-2-oxoethyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide?
The canonical SMILES for N-[2-(cyclopropylamino)-2-oxoethyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide is O=C(CNC(=O)c1cccc2c1NCCC2)NC1CC1.
What is the InChIKey of N-[2-(cyclopropylamino)-2-oxoethyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide?
The InChIKey is WOEJNGZZKSPIEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c19-13(18-11-6-7-11)9-17-15(20)12-5-1-3-10-4-2-8-16-14(10)12/h1,3,5,11,16H,2,4,6-9H2,(H,17,20)(H,18,19).
What are the key properties of N-[2-(cyclopropylamino)-2-oxoethyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide?
N-[2-(cyclopropylamino)-2-oxoethyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide has a molecular weight of 273.34 g/mol, XLogP of 1.05, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylamino)-2-oxoethyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide is sourced from PubChem (CID 62212757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).