N-methyl-7,8-dihydronaphthalen-1-amine

C11H13N — CID 145048997

IUPACN-methyl-7,8-dihydronaphthalen-1-amine
SMILESCNc1cccc2c1CCC=C2
InChIInChI=1S/C11H13N/c1-12-11-8-4-6-9-5-2-3-7-10(9)11/h2,4-6,8,12H,3,7H2,1H3
InChIKeyVNAQIJCCKUKKHZ-UHFFFAOYSA-N
MW159.23 g/mol
LogP2.69
Rot. Bonds1

About N-methyl-7,8-dihydronaphthalen-1-amine

N-methyl-7,8-dihydronaphthalen-1-amine (PubChem CID 145048997) has the molecular formula C11H13N and a molecular weight of 159.23 g/mol. Its IUPAC name is N-methyl-7,8-dihydronaphthalen-1-amine.

Molecular Properties

Compound NameN-methyl-7,8-dihydronaphthalen-1-amine
PubChem CID145048997
Molecular FormulaC11H13N
Molecular Weight159.23 g/mol
Exact Mass159.10
IUPAC NameN-methyl-7,8-dihydronaphthalen-1-amine
SMILESCNc1cccc2c1CCC=C2
InChIInChI=1S/C11H13N/c1-12-11-8-4-6-9-5-2-3-7-10(9)11/h2,4-6,8,12H,3,7H2,1H3
InChIKeyVNAQIJCCKUKKHZ-UHFFFAOYSA-N
XLogP2.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-7,8-dihydronaphthalen-1-amine?
The IUPAC name of N-methyl-7,8-dihydronaphthalen-1-amine (CID 145048997) is N-methyl-7,8-dihydronaphthalen-1-amine.
What is the SMILES notation for N-methyl-7,8-dihydronaphthalen-1-amine?
The canonical SMILES for N-methyl-7,8-dihydronaphthalen-1-amine is CNc1cccc2c1CCC=C2.
What is the InChIKey of N-methyl-7,8-dihydronaphthalen-1-amine?
The InChIKey is VNAQIJCCKUKKHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N/c1-12-11-8-4-6-9-5-2-3-7-10(9)11/h2,4-6,8,12H,3,7H2,1H3.
What are the key properties of N-methyl-7,8-dihydronaphthalen-1-amine?
N-methyl-7,8-dihydronaphthalen-1-amine has a molecular weight of 159.23 g/mol, XLogP of 2.69, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-7,8-dihydronaphthalen-1-amine is sourced from PubChem (CID 145048997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).