4-methyl-N-[(6-methyl-2-pyridinyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine

C18H22N2 — CID 81326890

IUPAC4-methyl-N-[(6-methyl-2-pyridinyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCc1cccc(CNC2CCC(C)c3ccccc32)n1
InChIInChI=1S/C18H22N2/c1-13-10-11-18(17-9-4-3-8-16(13)17)19-12-15-7-5-6-14(2)20-15/h3-9,13,18-19H,10-12H2,1-2H3
InChIKeyPHFVSXRPOVLZGP-UHFFFAOYSA-N
MW266.39 g/mol
LogP4.12
Rot. Bonds3

About 4-methyl-N-[(6-methyl-2-pyridinyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine

4-methyl-N-[(6-methyl-2-pyridinyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 81326890) has the molecular formula C18H22N2 and a molecular weight of 266.39 g/mol. Its IUPAC name is 4-methyl-N-[(6-methyl-2-pyridinyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound Name4-methyl-N-[(6-methyl-2-pyridinyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID81326890
Molecular FormulaC18H22N2
Molecular Weight266.39 g/mol
Exact Mass266.18
IUPAC Name4-methyl-N-[(6-methyl-2-pyridinyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCc1cccc(CNC2CCC(C)c3ccccc32)n1
InChIInChI=1S/C18H22N2/c1-13-10-11-18(17-9-4-3-8-16(13)17)19-12-15-7-5-6-14(2)20-15/h3-9,13,18-19H,10-12H2,1-2H3
InChIKeyPHFVSXRPOVLZGP-UHFFFAOYSA-N
XLogP4.12
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(6-methyl-2-pyridinyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of 4-methyl-N-[(6-methyl-2-pyridinyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine (CID 81326890) is 4-methyl-N-[(6-methyl-2-pyridinyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for 4-methyl-N-[(6-methyl-2-pyridinyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for 4-methyl-N-[(6-methyl-2-pyridinyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine is Cc1cccc(CNC2CCC(C)c3ccccc32)n1.
What is the InChIKey of 4-methyl-N-[(6-methyl-2-pyridinyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is PHFVSXRPOVLZGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2/c1-13-10-11-18(17-9-4-3-8-16(13)17)19-12-15-7-5-6-14(2)20-15/h3-9,13,18-19H,10-12H2,1-2H3.
What are the key properties of 4-methyl-N-[(6-methyl-2-pyridinyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine?
4-methyl-N-[(6-methyl-2-pyridinyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 266.39 g/mol, XLogP of 4.12, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(6-methyl-2-pyridinyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 81326890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).