2,2-dimethyl-N-[(6-methyl-3-pyridinyl)methyl]-3,4-dihydro-1H-naphthalen-1-amine

C19H24N2 — CID 115532070

IUPAC2,2-dimethyl-N-[(6-methyl-3-pyridinyl)methyl]-3,4-dihydro-1H-naphthalen-1-amine
SMILESCc1ccc(CNC2c3ccccc3CCC2(C)C)cn1
InChIInChI=1S/C19H24N2/c1-14-8-9-15(12-20-14)13-21-18-17-7-5-4-6-16(17)10-11-19(18,2)3/h4-9,12,18,21H,10-11,13H2,1-3H3
InChIKeyPMOFQVUCFMGWHI-UHFFFAOYSA-N
MW280.42 g/mol
LogP4.19
Rot. Bonds3

About 2,2-dimethyl-N-[(6-methyl-3-pyridinyl)methyl]-3,4-dihydro-1H-naphthalen-1-amine

2,2-dimethyl-N-[(6-methyl-3-pyridinyl)methyl]-3,4-dihydro-1H-naphthalen-1-amine (PubChem CID 115532070) has the molecular formula C19H24N2 and a molecular weight of 280.42 g/mol. Its IUPAC name is 2,2-dimethyl-N-[(6-methyl-3-pyridinyl)methyl]-3,4-dihydro-1H-naphthalen-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-N-[(6-methyl-3-pyridinyl)methyl]-3,4-dihydro-1H-naphthalen-1-amine
PubChem CID115532070
Molecular FormulaC19H24N2
Molecular Weight280.42 g/mol
Exact Mass280.19
IUPAC Name2,2-dimethyl-N-[(6-methyl-3-pyridinyl)methyl]-3,4-dihydro-1H-naphthalen-1-amine
SMILESCc1ccc(CNC2c3ccccc3CCC2(C)C)cn1
InChIInChI=1S/C19H24N2/c1-14-8-9-15(12-20-14)13-21-18-17-7-5-4-6-16(17)10-11-19(18,2)3/h4-9,12,18,21H,10-11,13H2,1-3H3
InChIKeyPMOFQVUCFMGWHI-UHFFFAOYSA-N
XLogP4.19
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[(6-methyl-3-pyridinyl)methyl]-3,4-dihydro-1H-naphthalen-1-amine?
The IUPAC name of 2,2-dimethyl-N-[(6-methyl-3-pyridinyl)methyl]-3,4-dihydro-1H-naphthalen-1-amine (CID 115532070) is 2,2-dimethyl-N-[(6-methyl-3-pyridinyl)methyl]-3,4-dihydro-1H-naphthalen-1-amine.
What is the SMILES notation for 2,2-dimethyl-N-[(6-methyl-3-pyridinyl)methyl]-3,4-dihydro-1H-naphthalen-1-amine?
The canonical SMILES for 2,2-dimethyl-N-[(6-methyl-3-pyridinyl)methyl]-3,4-dihydro-1H-naphthalen-1-amine is Cc1ccc(CNC2c3ccccc3CCC2(C)C)cn1.
What is the InChIKey of 2,2-dimethyl-N-[(6-methyl-3-pyridinyl)methyl]-3,4-dihydro-1H-naphthalen-1-amine?
The InChIKey is PMOFQVUCFMGWHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c1-14-8-9-15(12-20-14)13-21-18-17-7-5-4-6-16(17)10-11-19(18,2)3/h4-9,12,18,21H,10-11,13H2,1-3H3.
What are the key properties of 2,2-dimethyl-N-[(6-methyl-3-pyridinyl)methyl]-3,4-dihydro-1H-naphthalen-1-amine?
2,2-dimethyl-N-[(6-methyl-3-pyridinyl)methyl]-3,4-dihydro-1H-naphthalen-1-amine has a molecular weight of 280.42 g/mol, XLogP of 4.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[(6-methyl-3-pyridinyl)methyl]-3,4-dihydro-1H-naphthalen-1-amine is sourced from PubChem (CID 115532070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).