N-(4-hydroxycyclohexyl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide

C15H21N3O2 — CID 104614341

IUPACN-(4-hydroxycyclohexyl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
SMILESO=C(NC1CCC(O)CC1)c1ccc2c(c1)NCCN2
InChIInChI=1S/C15H21N3O2/c19-12-4-2-11(3-5-12)18-15(20)10-1-6-13-14(9-10)17-8-7-16-13/h1,6,9,11-12,16-17,19H,2-5,7-8H2,(H,18,20)
InChIKeyFMZHPENDMFZZHW-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.56
Rot. Bonds2

About N-(4-hydroxycyclohexyl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide

N-(4-hydroxycyclohexyl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide (PubChem CID 104614341) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is N-(4-hydroxycyclohexyl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxycyclohexyl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
PubChem CID104614341
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC NameN-(4-hydroxycyclohexyl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
SMILESO=C(NC1CCC(O)CC1)c1ccc2c(c1)NCCN2
InChIInChI=1S/C15H21N3O2/c19-12-4-2-11(3-5-12)18-15(20)10-1-6-13-14(9-10)17-8-7-16-13/h1,6,9,11-12,16-17,19H,2-5,7-8H2,(H,18,20)
InChIKeyFMZHPENDMFZZHW-UHFFFAOYSA-N
XLogP1.56
TPSA73.39 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.56
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-2,3-dihydro-1H-indole-5-carboxamide
CID 43142413
N-(4-hydroxycyclohexyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 103605870
N-(1-methyl-6-oxopiperidin-3-yl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
CID 104615091
4-amino-N-(4-hydroxycyclohexyl)-3-methoxybenzamide
CID 89028279
N-cyclopentyl-2,3-dihydro-1H-indole-6-carboxamide
CID 113382512
3-acetamido-N-(4-hydroxycyclohexyl)benzamide
CID 43389328
N-(3-ethyl-2-methylcyclopentyl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
CID 104615105
N-(4-ethylcyclohexyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 61470340
N-(1,3-dimethylpiperidin-4-yl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
CID 114504320
N-(3-hydroxycyclohexyl)-1,2,3,4-tetrahydroquinoline-6-carboxamide
CID 43696101
1,2,3,4-tetrahydroquinoxaline-6-carboxamide
CID 69495489
4-acetamido-N-(4-hydroxycyclohexyl)benzamide
CID 43389222

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxycyclohexyl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide?
The IUPAC name of N-(4-hydroxycyclohexyl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide (CID 104614341) is N-(4-hydroxycyclohexyl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide.
What is the SMILES notation for N-(4-hydroxycyclohexyl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide?
The canonical SMILES for N-(4-hydroxycyclohexyl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide is O=C(NC1CCC(O)CC1)c1ccc2c(c1)NCCN2.
What is the InChIKey of N-(4-hydroxycyclohexyl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide?
The InChIKey is FMZHPENDMFZZHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c19-12-4-2-11(3-5-12)18-15(20)10-1-6-13-14(9-10)17-8-7-16-13/h1,6,9,11-12,16-17,19H,2-5,7-8H2,(H,18,20).
What are the key properties of N-(4-hydroxycyclohexyl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide?
N-(4-hydroxycyclohexyl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide has a molecular weight of 275.35 g/mol, XLogP of 1.56, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxycyclohexyl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide is sourced from PubChem (CID 104614341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).