2-[1-(2-methylnaphthalen-1-yl)naphthalen-2-yl]ethanamine

C23H21N — CID 101269623

IUPAC2-[1-(2-methylnaphthalen-1-yl)naphthalen-2-yl]ethanamine
SMILESCc1ccc2ccccc2c1-c1c(CCN)ccc2ccccc12
InChIInChI=1S/C23H21N/c1-16-10-11-17-6-2-4-8-20(17)22(16)23-19(14-15-24)13-12-18-7-3-5-9-21(18)23/h2-13H,14-15,24H2,1H3
InChIKeyGBVSQPBIILDUMU-UHFFFAOYSA-N
MW311.43 g/mol
LogP5.47
Rot. Bonds3

About 2-[1-(2-methylnaphthalen-1-yl)naphthalen-2-yl]ethanamine

2-[1-(2-methylnaphthalen-1-yl)naphthalen-2-yl]ethanamine (PubChem CID 101269623) has the molecular formula C23H21N and a molecular weight of 311.43 g/mol. Its IUPAC name is 2-[1-(2-methylnaphthalen-1-yl)naphthalen-2-yl]ethanamine.

Molecular Properties

Compound Name2-[1-(2-methylnaphthalen-1-yl)naphthalen-2-yl]ethanamine
PubChem CID101269623
Molecular FormulaC23H21N
Molecular Weight311.43 g/mol
Exact Mass311.17
IUPAC Name2-[1-(2-methylnaphthalen-1-yl)naphthalen-2-yl]ethanamine
SMILESCc1ccc2ccccc2c1-c1c(CCN)ccc2ccccc12
InChIInChI=1S/C23H21N/c1-16-10-11-17-6-2-4-8-20(17)22(16)23-19(14-15-24)13-12-18-7-3-5-9-21(18)23/h2-13H,14-15,24H2,1H3
InChIKeyGBVSQPBIILDUMU-UHFFFAOYSA-N
XLogP5.47
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500311.43
LogP ≤ 55.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-1-(2-methylnaphthalen-1-yl)naphthalene;sulfane
CID 155977678
2-propyl-1-(2-propylnaphthalen-1-yl)naphthalene
CID 59336410
1-(2-methylnaphthalen-1-yl)naphthalen-2-amine
CID 18736750
2-butyl-1-(2-butylnaphthalen-1-yl)naphthalene
CID 59129933
2-[1-[2-(2-hydroxyethyl)naphthalen-1-yl]naphthalen-2-yl]ethanol
CID 10405122
2-methyl-1-(2-methylphenyl)naphthalene
CID 14204979
1-(2-methylnaphthalen-1-yl)-2-phenylnaphthalene
CID 11739441
2-[4-[3-(2-aminoethyl)-2-methoxynaphthalen-1-yl]-3-methoxynaphthalen-2-yl]ethanamine
CID 170886487
[5-chloro-2-(2-methylnaphthalen-1-yl)phenyl]methanamine
CID 81431357
3-(4-methylnaphthalen-1-yl)propan-1-amine
CID 55266988
2-(2-aminoethyl)naphthalene-1-sulfonamide
CID 67868912
3-bromo-2-methyl-1-(2-methylnaphthalen-1-yl)naphthalene
CID 174680926

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-methylnaphthalen-1-yl)naphthalen-2-yl]ethanamine?
The IUPAC name of 2-[1-(2-methylnaphthalen-1-yl)naphthalen-2-yl]ethanamine (CID 101269623) is 2-[1-(2-methylnaphthalen-1-yl)naphthalen-2-yl]ethanamine.
What is the SMILES notation for 2-[1-(2-methylnaphthalen-1-yl)naphthalen-2-yl]ethanamine?
The canonical SMILES for 2-[1-(2-methylnaphthalen-1-yl)naphthalen-2-yl]ethanamine is Cc1ccc2ccccc2c1-c1c(CCN)ccc2ccccc12.
What is the InChIKey of 2-[1-(2-methylnaphthalen-1-yl)naphthalen-2-yl]ethanamine?
The InChIKey is GBVSQPBIILDUMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N/c1-16-10-11-17-6-2-4-8-20(17)22(16)23-19(14-15-24)13-12-18-7-3-5-9-21(18)23/h2-13H,14-15,24H2,1H3.
What are the key properties of 2-[1-(2-methylnaphthalen-1-yl)naphthalen-2-yl]ethanamine?
2-[1-(2-methylnaphthalen-1-yl)naphthalen-2-yl]ethanamine has a molecular weight of 311.43 g/mol, XLogP of 5.47, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-methylnaphthalen-1-yl)naphthalen-2-yl]ethanamine is sourced from PubChem (CID 101269623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).