N-(2-hydroxyethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide

C12H16N2O2 — CID 106901213

IUPACN-(2-hydroxyethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
SMILESO=C(NCCO)C1CNc2ccccc2C1
InChIInChI=1S/C12H16N2O2/c15-6-5-13-12(16)10-7-9-3-1-2-4-11(9)14-8-10/h1-4,10,14-15H,5-8H2,(H,13,16)
InChIKeyFZLDAHHZGHLADH-UHFFFAOYSA-N
MW220.27 g/mol
LogP0.38
Rot. Bonds3

About N-(2-hydroxyethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide

N-(2-hydroxyethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide (PubChem CID 106901213) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
PubChem CID106901213
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC NameN-(2-hydroxyethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
SMILESO=C(NCCO)C1CNc2ccccc2C1
InChIInChI=1S/C12H16N2O2/c15-6-5-13-12(16)10-7-9-3-1-2-4-11(9)14-8-10/h1-4,10,14-15H,5-8H2,(H,13,16)
InChIKeyFZLDAHHZGHLADH-UHFFFAOYSA-N
XLogP0.38
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 50.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-cyclobutylethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901730
N-pent-3-ynyl-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901779
N-(5,5,5-trifluoropentyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 115519993
N-(3-hydroxypentyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901745
N-[(4-hydroxycyclohexyl)methyl]-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106135423
N-[(2S)-1-hydroxypropan-2-yl]-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 107219186
N-(2H-tetrazol-5-ylmethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901428
N-(thiophen-3-ylmethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901469
(3S)-1,2,3,4-tetrahydroquinoline-3-carboxylic acid
CID 34181194
N-[1-(hydroxymethyl)cyclopentyl]-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901441
N-[(4-methylthiophen-3-yl)methyl]-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106901620
N-(4-hydroxy-1-methoxybutan-2-yl)-1,2,3,4-tetrahydroquinoline-3-carboxamide
CID 106160965

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide (CID 106901213) is N-(2-hydroxyethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide is O=C(NCCO)C1CNc2ccccc2C1.
What is the InChIKey of N-(2-hydroxyethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide?
The InChIKey is FZLDAHHZGHLADH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c15-6-5-13-12(16)10-7-9-3-1-2-4-11(9)14-8-10/h1-4,10,14-15H,5-8H2,(H,13,16).
What are the key properties of N-(2-hydroxyethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide?
N-(2-hydroxyethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide has a molecular weight of 220.27 g/mol, XLogP of 0.38, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-1,2,3,4-tetrahydroquinoline-3-carboxamide is sourced from PubChem (CID 106901213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).