N,N-dimethyl-5-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-amine

C17H20N2 — CID 25070235

IUPACN,N-dimethyl-5-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCN(C)C1CCc2c(cccc2-c2cccnc2)C1
InChIInChI=1S/C17H20N2/c1-19(2)15-8-9-17-13(11-15)5-3-7-16(17)14-6-4-10-18-12-14/h3-7,10,12,15H,8-9,11H2,1-2H3
InChIKeySOEUECFXLSUTEP-UHFFFAOYSA-N
MW252.36 g/mol
LogP3.17
Rot. Bonds2

About N,N-dimethyl-5-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-amine

N,N-dimethyl-5-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-amine (PubChem CID 25070235) has the molecular formula C17H20N2 and a molecular weight of 252.36 g/mol. Its IUPAC name is N,N-dimethyl-5-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-5-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-amine
PubChem CID25070235
Molecular FormulaC17H20N2
Molecular Weight252.36 g/mol
Exact Mass252.16
IUPAC NameN,N-dimethyl-5-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESCN(C)C1CCc2c(cccc2-c2cccnc2)C1
InChIInChI=1S/C17H20N2/c1-19(2)15-8-9-17-13(11-15)5-3-7-16(17)14-6-4-10-18-12-14/h3-7,10,12,15H,8-9,11H2,1-2H3
InChIKeySOEUECFXLSUTEP-UHFFFAOYSA-N
XLogP3.17
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-5-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-amine?
The IUPAC name of N,N-dimethyl-5-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-amine (CID 25070235) is N,N-dimethyl-5-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-amine.
What is the SMILES notation for N,N-dimethyl-5-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-amine?
The canonical SMILES for N,N-dimethyl-5-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-amine is CN(C)C1CCc2c(cccc2-c2cccnc2)C1.
What is the InChIKey of N,N-dimethyl-5-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-amine?
The InChIKey is SOEUECFXLSUTEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2/c1-19(2)15-8-9-17-13(11-15)5-3-7-16(17)14-6-4-10-18-12-14/h3-7,10,12,15H,8-9,11H2,1-2H3.
What are the key properties of N,N-dimethyl-5-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-amine?
N,N-dimethyl-5-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-amine has a molecular weight of 252.36 g/mol, XLogP of 3.17, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-5-pyridin-3-yl-1,2,3,4-tetrahydronaphthalen-2-amine is sourced from PubChem (CID 25070235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).