5-chloro-6-(5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)pyridin-2-amine

C16H17ClN2O — CID 62885826

IUPAC5-chloro-6-(5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)pyridin-2-amine
SMILESNc1ccc(Cl)c(COc2ccc3c(c2)CCCC3)n1
InChIInChI=1S/C16H17ClN2O/c17-14-7-8-16(18)19-15(14)10-20-13-6-5-11-3-1-2-4-12(11)9-13/h5-9H,1-4,10H2,(H2,18,19)
InChIKeyQMTOETUURZXJFP-UHFFFAOYSA-N
MW288.78 g/mol
LogP3.78
Rot. Bonds3

About 5-chloro-6-(5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)pyridin-2-amine

5-chloro-6-(5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)pyridin-2-amine (PubChem CID 62885826) has the molecular formula C16H17ClN2O and a molecular weight of 288.78 g/mol. Its IUPAC name is 5-chloro-6-(5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-6-(5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)pyridin-2-amine
PubChem CID62885826
Molecular FormulaC16H17ClN2O
Molecular Weight288.78 g/mol
Exact Mass288.10
IUPAC Name5-chloro-6-(5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)pyridin-2-amine
SMILESNc1ccc(Cl)c(COc2ccc3c(c2)CCCC3)n1
InChIInChI=1S/C16H17ClN2O/c17-14-7-8-16(18)19-15(14)10-20-13-6-5-11-3-1-2-4-12(11)9-13/h5-9H,1-4,10H2,(H2,18,19)
InChIKeyQMTOETUURZXJFP-UHFFFAOYSA-N
XLogP3.78
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.78
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-6-(2,3-dihydro-1H-inden-5-yloxymethyl)pyridin-2-amine
CID 55127792
5-chloro-6-[(4-methylphenoxy)methyl]pyridin-2-amine
CID 62887232
5-chloro-6-[(4-iodophenoxy)methyl]pyridin-2-amine
CID 55127794
5-chloro-6-[(3,5-difluorophenoxy)methyl]pyridin-2-amine
CID 55127269
2-chloro-6-(2,3-dihydro-1H-inden-5-yloxymethyl)pyridine
CID 79241095
5-chloro-6-[(3-propan-2-ylphenoxy)methyl]pyridin-2-amine
CID 55127790
5-chloro-6-[(2,4,6-tribromophenoxy)methyl]pyridin-2-amine
CID 55192325
5-chloro-6-[(2,4-dichlorophenoxy)methyl]pyridin-2-amine
CID 62887044
5-(2,3-dihydro-1H-inden-5-yloxymethyl)-1,3-thiazol-2-amine
CID 79774116
5-[(4-chloro-3-nitrophenyl)methoxy]-2,3-dihydro-1H-indene
CID 43350469
2-chloro-5-(2,3-dihydro-1H-inden-5-yloxymethyl)-1,3,4-thiadiazole
CID 80606126
4-(2,3-dihydro-1H-inden-5-yloxymethyl)pyrimidine-5-carboxylic acid
CID 102973562

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-(5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)pyridin-2-amine?
The IUPAC name of 5-chloro-6-(5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)pyridin-2-amine (CID 62885826) is 5-chloro-6-(5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)pyridin-2-amine.
What is the SMILES notation for 5-chloro-6-(5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)pyridin-2-amine?
The canonical SMILES for 5-chloro-6-(5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)pyridin-2-amine is Nc1ccc(Cl)c(COc2ccc3c(c2)CCCC3)n1.
What is the InChIKey of 5-chloro-6-(5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)pyridin-2-amine?
The InChIKey is QMTOETUURZXJFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O/c17-14-7-8-16(18)19-15(14)10-20-13-6-5-11-3-1-2-4-12(11)9-13/h5-9H,1-4,10H2,(H2,18,19).
What are the key properties of 5-chloro-6-(5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)pyridin-2-amine?
5-chloro-6-(5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)pyridin-2-amine has a molecular weight of 288.78 g/mol, XLogP of 3.78, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-(5,6,7,8-tetrahydronaphthalen-2-yloxymethyl)pyridin-2-amine is sourced from PubChem (CID 62885826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).