(7-chloro-2,6-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanol

C15H17ClN2O — CID 82451741

IUPAC(7-chloro-2,6-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanol
SMILESCc1c(Cl)ccc2c(CO)c3c(nc12)CCN(C)C3
InChIInChI=1S/C15H17ClN2O/c1-9-13(16)4-3-10-12(8-19)11-7-18(2)6-5-14(11)17-15(9)10/h3-4,19H,5-8H2,1-2H3
InChIKeyIKUHUTQDDINNHT-UHFFFAOYSA-N
MW276.77 g/mol
LogP2.68
Rot. Bonds1

About (7-chloro-2,6-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanol

(7-chloro-2,6-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanol (PubChem CID 82451741) has the molecular formula C15H17ClN2O and a molecular weight of 276.77 g/mol. Its IUPAC name is (7-chloro-2,6-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanol.

Molecular Properties

Compound Name(7-chloro-2,6-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanol
PubChem CID82451741
Molecular FormulaC15H17ClN2O
Molecular Weight276.77 g/mol
Exact Mass276.10
IUPAC Name(7-chloro-2,6-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanol
SMILESCc1c(Cl)ccc2c(CO)c3c(nc12)CCN(C)C3
InChIInChI=1S/C15H17ClN2O/c1-9-13(16)4-3-10-12(8-19)11-7-18(2)6-5-14(11)17-15(9)10/h3-4,19H,5-8H2,1-2H3
InChIKeyIKUHUTQDDINNHT-UHFFFAOYSA-N
XLogP2.68
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.77
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (7-chloro-2,6-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanol with MolForge

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Related Compounds

(6-chloro-5-methyl-1,2,3,4-tetrahydroacridin-9-yl)methanol
CID 82451718
(6,7-dichloro-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanamine
CID 82451582
1-(7-chloro-2-ethyl-6-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)-N-methylmethanamine
CID 82451762
N-[(2,6,7-trimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methyl]propan-1-amine
CID 82450691
(8-bromo-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanol
CID 82451326
6,7-dichloro-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carbaldehyde
CID 82451578
2,6,7-trimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridine-10-carbothioamide
CID 82450693
2-(8-chloro-2,6-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)acetic acid
CID 82451803
2-(6-chloro-5-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)acetonitrile
CID 82451706
(6-ethyl-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanethiol
CID 82450181
(6-ethyl-2-methyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanamine
CID 82450182
7-chloro-2,8-dimethyl-3,4-dihydro-1H-isoquinoline
CID 84666615

Frequently Asked Questions

What is the IUPAC name of (7-chloro-2,6-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanol?
The IUPAC name of (7-chloro-2,6-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanol (CID 82451741) is (7-chloro-2,6-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanol.
What is the SMILES notation for (7-chloro-2,6-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanol?
The canonical SMILES for (7-chloro-2,6-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanol is Cc1c(Cl)ccc2c(CO)c3c(nc12)CCN(C)C3.
What is the InChIKey of (7-chloro-2,6-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanol?
The InChIKey is IKUHUTQDDINNHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2O/c1-9-13(16)4-3-10-12(8-19)11-7-18(2)6-5-14(11)17-15(9)10/h3-4,19H,5-8H2,1-2H3.
What are the key properties of (7-chloro-2,6-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanol?
(7-chloro-2,6-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanol has a molecular weight of 276.77 g/mol, XLogP of 2.68, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (7-chloro-2,6-dimethyl-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)methanol is sourced from PubChem (CID 82451741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).