(10-methoxy-1,2,3,4-tetrahydrobenzo[h][1,6]naphthyridin-8-yl)methanol

C14H16N2O2 — CID 141266028

IUPAC(10-methoxy-1,2,3,4-tetrahydrobenzo[h][1,6]naphthyridin-8-yl)methanol
SMILESCOc1cc(CO)cc2ncc3c(c12)NCCC3
InChIInChI=1S/C14H16N2O2/c1-18-12-6-9(8-17)5-11-13(12)14-10(7-16-11)3-2-4-15-14/h5-7,15,17H,2-4,8H2,1H3
InChIKeyAKVQOFMODYSKMB-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.09
Rot. Bonds2

About (10-methoxy-1,2,3,4-tetrahydrobenzo[h][1,6]naphthyridin-8-yl)methanol

(10-methoxy-1,2,3,4-tetrahydrobenzo[h][1,6]naphthyridin-8-yl)methanol (PubChem CID 141266028) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is (10-methoxy-1,2,3,4-tetrahydrobenzo[h][1,6]naphthyridin-8-yl)methanol.

Molecular Properties

Compound Name(10-methoxy-1,2,3,4-tetrahydrobenzo[h][1,6]naphthyridin-8-yl)methanol
PubChem CID141266028
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name(10-methoxy-1,2,3,4-tetrahydrobenzo[h][1,6]naphthyridin-8-yl)methanol
SMILESCOc1cc(CO)cc2ncc3c(c12)NCCC3
InChIInChI=1S/C14H16N2O2/c1-18-12-6-9(8-17)5-11-13(12)14-10(7-16-11)3-2-4-15-14/h5-7,15,17H,2-4,8H2,1H3
InChIKeyAKVQOFMODYSKMB-UHFFFAOYSA-N
XLogP2.09
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,2,2-trifluoro-N-(1,2,3,4-tetrahydrobenzo[h][1,6]naphthyridin-8-ylmethyl)ethanamine
CID 141265995
[4-(cyclobutylmethoxy)-3,5-dimethoxyphenyl]methanol
CID 65458991
9-tert-butyl-2,3,4,7-tetrahydro-1H-pyrrolo[2,3-h][1,6]naphthyridine
CID 146393716
6-(hydroxymethyl)-8-methoxy-1,4-dihydro-3,1-benzoxazin-2-one
CID 139777702
6-[(4-methoxy-1-methylpyrazol-5-yl)methyl]-1,2,3,4-tetrahydroquinoline
CID 114662277
(6-chloro-5-methoxy-3-pyridinyl)methanol
CID 59297074
8,9-dimethoxy-1,2,3,4-tetrahydrobenzo[h]quinoline
CID 15402109
[4-(cyclohexylmethoxy)-3,5-dimethoxyphenyl]methanol
CID 15752535
8-[(dimethylamino)methyl]-10-methoxy-2,3,4,6-tetrahydro-1H-benzo[h][1,6]naphthyridin-5-one;8-(hydroxymethyl)-10-methoxy-6-(methoxymethyl)-1,2,3,4-tetrahydrobenzo[h][1,6]naphthyridin-5-one
CID 158923153
8-methoxy-6-pyrazolo[1,5-a]pyrimidin-3-yl-1,2,3,4-tetrahydroquinoline
CID 166393596
8-butyl-10-methoxy-2,3,4,6-tetrahydro-1H-benzo[h][1,6]naphthyridin-5-one
CID 58424896
8-[[2-chloroethyl(methyl)amino]methyl]-10-methoxy-2,3,4,6-tetrahydro-1H-benzo[h][1,6]naphthyridin-5-one
CID 58424892

Frequently Asked Questions

What is the IUPAC name of (10-methoxy-1,2,3,4-tetrahydrobenzo[h][1,6]naphthyridin-8-yl)methanol?
The IUPAC name of (10-methoxy-1,2,3,4-tetrahydrobenzo[h][1,6]naphthyridin-8-yl)methanol (CID 141266028) is (10-methoxy-1,2,3,4-tetrahydrobenzo[h][1,6]naphthyridin-8-yl)methanol.
What is the SMILES notation for (10-methoxy-1,2,3,4-tetrahydrobenzo[h][1,6]naphthyridin-8-yl)methanol?
The canonical SMILES for (10-methoxy-1,2,3,4-tetrahydrobenzo[h][1,6]naphthyridin-8-yl)methanol is COc1cc(CO)cc2ncc3c(c12)NCCC3.
What is the InChIKey of (10-methoxy-1,2,3,4-tetrahydrobenzo[h][1,6]naphthyridin-8-yl)methanol?
The InChIKey is AKVQOFMODYSKMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-18-12-6-9(8-17)5-11-13(12)14-10(7-16-11)3-2-4-15-14/h5-7,15,17H,2-4,8H2,1H3.
What are the key properties of (10-methoxy-1,2,3,4-tetrahydrobenzo[h][1,6]naphthyridin-8-yl)methanol?
(10-methoxy-1,2,3,4-tetrahydrobenzo[h][1,6]naphthyridin-8-yl)methanol has a molecular weight of 244.29 g/mol, XLogP of 2.09, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (10-methoxy-1,2,3,4-tetrahydrobenzo[h][1,6]naphthyridin-8-yl)methanol is sourced from PubChem (CID 141266028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).