(5,6,7,8-tetrahydroquinolin-7-ylamino)methanol

C10H14N2O — CID 14835920

IUPAC(5,6,7,8-tetrahydroquinolin-7-ylamino)methanol
SMILESOCNC1CCc2cccnc2C1
InChIInChI=1S/C10H14N2O/c13-7-12-9-4-3-8-2-1-5-11-10(8)6-9/h1-2,5,9,12-13H,3-4,6-7H2
InChIKeyLEHUREIPVMDTTD-UHFFFAOYSA-N
MW178.24 g/mol
LogP0.48
Rot. Bonds2

About (5,6,7,8-tetrahydroquinolin-7-ylamino)methanol

(5,6,7,8-tetrahydroquinolin-7-ylamino)methanol (PubChem CID 14835920) has the molecular formula C10H14N2O and a molecular weight of 178.24 g/mol. Its IUPAC name is (5,6,7,8-tetrahydroquinolin-7-ylamino)methanol.

Molecular Properties

Compound Name(5,6,7,8-tetrahydroquinolin-7-ylamino)methanol
PubChem CID14835920
Molecular FormulaC10H14N2O
Molecular Weight178.24 g/mol
Exact Mass178.11
IUPAC Name(5,6,7,8-tetrahydroquinolin-7-ylamino)methanol
SMILESOCNC1CCc2cccnc2C1
InChIInChI=1S/C10H14N2O/c13-7-12-9-4-3-8-2-1-5-11-10(8)6-9/h1-2,5,9,12-13H,3-4,6-7H2
InChIKeyLEHUREIPVMDTTD-UHFFFAOYSA-N
XLogP0.48
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

tert-butyl N-[[4-[(5,6,7,8-tetrahydroquinolin-7-ylamino)methyl]phenyl]methyl]carbamate
CID 68900505
2-[[(7S)-5,6,7,8-tetrahydroquinolin-7-yl]amino]pyrimidine-5-carboxamide
CID 156678006
N-(5,6,7,8-tetrahydroquinolin-7-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 70794757
ethane;(7S)-7-methyl-5,6,7,8-tetrahydroquinoline
CID 143143665
5,6,7,8-tetrahydroquinolin-7-amine;hydrochloride
CID 156621052
7-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroquinoline
CID 138515872
5,6,7,8-tetrahydroquinolin-6-ylmethanol
CID 69108967
(7S)-7-tert-butyl-5,6,7,8-tetrahydroquinoline
CID 69281697
6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-7-ylmethanamine
CID 123242170
6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-8-ylmethylphosphane
CID 145086188
7-(azetidin-1-yl)-5,6,7,8-tetrahydroquinoline
CID 14835988
(Z)-2-N-iodo-1-(5,6,7,8-tetrahydroquinolin-7-yl)but-2-ene-2,3-diamine
CID 89261198

Frequently Asked Questions

What is the IUPAC name of (5,6,7,8-tetrahydroquinolin-7-ylamino)methanol?
The IUPAC name of (5,6,7,8-tetrahydroquinolin-7-ylamino)methanol (CID 14835920) is (5,6,7,8-tetrahydroquinolin-7-ylamino)methanol.
What is the SMILES notation for (5,6,7,8-tetrahydroquinolin-7-ylamino)methanol?
The canonical SMILES for (5,6,7,8-tetrahydroquinolin-7-ylamino)methanol is OCNC1CCc2cccnc2C1.
What is the InChIKey of (5,6,7,8-tetrahydroquinolin-7-ylamino)methanol?
The InChIKey is LEHUREIPVMDTTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c13-7-12-9-4-3-8-2-1-5-11-10(8)6-9/h1-2,5,9,12-13H,3-4,6-7H2.
What are the key properties of (5,6,7,8-tetrahydroquinolin-7-ylamino)methanol?
(5,6,7,8-tetrahydroquinolin-7-ylamino)methanol has a molecular weight of 178.24 g/mol, XLogP of 0.48, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5,6,7,8-tetrahydroquinolin-7-ylamino)methanol is sourced from PubChem (CID 14835920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).