2-propan-2-yloxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-3-amine

C18H22N2O — CID 63454403

IUPAC2-propan-2-yloxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-3-amine
SMILESCC(C)Oc1ncccc1NC1CCc2ccccc2C1
InChIInChI=1S/C18H22N2O/c1-13(2)21-18-17(8-5-11-19-18)20-16-10-9-14-6-3-4-7-15(14)12-16/h3-8,11,13,16,20H,9-10,12H2,1-2H3
InChIKeyAKNXOCAUCZHNEC-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.84
Rot. Bonds4

About 2-propan-2-yloxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-3-amine

2-propan-2-yloxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-3-amine (PubChem CID 63454403) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is 2-propan-2-yloxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-3-amine.

Molecular Properties

Compound Name2-propan-2-yloxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-3-amine
PubChem CID63454403
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC Name2-propan-2-yloxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-3-amine
SMILESCC(C)Oc1ncccc1NC1CCc2ccccc2C1
InChIInChI=1S/C18H22N2O/c1-13(2)21-18-17(8-5-11-19-18)20-16-10-9-14-6-3-4-7-15(14)12-16/h3-8,11,13,16,20H,9-10,12H2,1-2H3
InChIKeyAKNXOCAUCZHNEC-UHFFFAOYSA-N
XLogP3.84
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(2-propan-2-yloxy-3-pyridinyl)amino]cyclohexan-1-ol
CID 106594487
N-(1,2,3,4-tetrahydronaphthalen-2-yl)quinolin-5-amine
CID 43759315
N-(2-methylcyclohexyl)-2-propan-2-yloxypyridin-3-amine
CID 63455454
N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-2-propan-2-yloxypyridin-3-amine
CID 115922180
3-methoxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-2-amine
CID 112568537
(2R)-N-(2-methoxyphenyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 31196228
1-ethyl-N-(2-propan-2-yloxy-3-pyridinyl)azepan-4-amine
CID 65073239
N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]pyridin-2-amine
CID 94392451
N-(2-methyloxolan-3-yl)-2-propan-2-yloxypyridin-3-amine
CID 82727184
N-(2-bicyclo[2.2.1]heptanyl)-2-propan-2-yloxypyridin-3-amine
CID 63454222
N-(2-tert-butylcyclohexyl)-2-propan-2-yloxypyridin-3-amine
CID 63455455
1-[(2-propan-2-yloxy-3-pyridinyl)amino]-2,3-dihydro-1H-inden-4-ol
CID 61379245

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yloxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-3-amine?
The IUPAC name of 2-propan-2-yloxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-3-amine (CID 63454403) is 2-propan-2-yloxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-3-amine.
What is the SMILES notation for 2-propan-2-yloxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-3-amine?
The canonical SMILES for 2-propan-2-yloxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-3-amine is CC(C)Oc1ncccc1NC1CCc2ccccc2C1.
What is the InChIKey of 2-propan-2-yloxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-3-amine?
The InChIKey is AKNXOCAUCZHNEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-13(2)21-18-17(8-5-11-19-18)20-16-10-9-14-6-3-4-7-15(14)12-16/h3-8,11,13,16,20H,9-10,12H2,1-2H3.
What are the key properties of 2-propan-2-yloxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-3-amine?
2-propan-2-yloxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-3-amine has a molecular weight of 282.39 g/mol, XLogP of 3.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yloxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridin-3-amine is sourced from PubChem (CID 63454403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).