3-naphthalen-2-ylbutan-2-amine

C14H17N — CID 66436107

IUPAC3-naphthalen-2-ylbutan-2-amine
SMILESCC(N)C(C)c1ccc2ccccc2c1
InChIInChI=1S/C14H17N/c1-10(11(2)15)13-8-7-12-5-3-4-6-14(12)9-13/h3-11H,15H2,1-2H3
InChIKeyMWTQUGZUPZAKPL-UHFFFAOYSA-N
MW199.30 g/mol
LogP3.29
Rot. Bonds2

About 3-naphthalen-2-ylbutan-2-amine

3-naphthalen-2-ylbutan-2-amine (PubChem CID 66436107) has the molecular formula C14H17N and a molecular weight of 199.30 g/mol. Its IUPAC name is 3-naphthalen-2-ylbutan-2-amine.

Molecular Properties

Compound Name3-naphthalen-2-ylbutan-2-amine
PubChem CID66436107
Molecular FormulaC14H17N
Molecular Weight199.30 g/mol
Exact Mass199.14
IUPAC Name3-naphthalen-2-ylbutan-2-amine
SMILESCC(N)C(C)c1ccc2ccccc2c1
InChIInChI=1S/C14H17N/c1-10(11(2)15)13-8-7-12-5-3-4-6-14(12)9-13/h3-11H,15H2,1-2H3
InChIKeyMWTQUGZUPZAKPL-UHFFFAOYSA-N
XLogP3.29
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-naphthalen-2-ylethanamine
CID 3857145
(1R,2S)-1,2-dinaphthalen-2-ylethane-1,2-diamine
CID 14048524
ethane;2-propan-2-ylnaphthalene
CID 142226111
2-propan-2-ylpentacene
CID 153380535
amino(naphthalen-2-yl)methanethiol
CID 116939563
1-naphthalen-2-ylethanethiol
CID 11672816
amino(naphthalen-2-yl)methanol
CID 57110079
dimethyl 2-[(1R)-1-naphthalen-2-ylethyl]propanedioate
CID 101238561
2-methyl-1-naphthalen-2-ylbutan-1-amine
CID 63718165
(1R)-3-methyl-1-naphthalen-2-ylbutan-1-amine;hydrochloride
CID 171201317
[(1S)-1-naphthalen-2-ylethyl]azanium chloride
CID 155931519
(2S,3R)-2-hydroxy-3-naphthalen-2-ylbutanenitrile
CID 100997633

Frequently Asked Questions

What is the IUPAC name of 3-naphthalen-2-ylbutan-2-amine?
The IUPAC name of 3-naphthalen-2-ylbutan-2-amine (CID 66436107) is 3-naphthalen-2-ylbutan-2-amine.
What is the SMILES notation for 3-naphthalen-2-ylbutan-2-amine?
The canonical SMILES for 3-naphthalen-2-ylbutan-2-amine is CC(N)C(C)c1ccc2ccccc2c1.
What is the InChIKey of 3-naphthalen-2-ylbutan-2-amine?
The InChIKey is MWTQUGZUPZAKPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N/c1-10(11(2)15)13-8-7-12-5-3-4-6-14(12)9-13/h3-11H,15H2,1-2H3.
What are the key properties of 3-naphthalen-2-ylbutan-2-amine?
3-naphthalen-2-ylbutan-2-amine has a molecular weight of 199.30 g/mol, XLogP of 3.29, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-naphthalen-2-ylbutan-2-amine is sourced from PubChem (CID 66436107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).