2-methyl-5-naphthalen-1-ylpentan-2-amine

C16H21N — CID 116925299

IUPAC2-methyl-5-naphthalen-1-ylpentan-2-amine
SMILESCC(C)(N)CCCc1cccc2ccccc12
InChIInChI=1S/C16H21N/c1-16(2,17)12-6-10-14-9-5-8-13-7-3-4-11-15(13)14/h3-5,7-9,11H,6,10,12,17H2,1-2H3
InChIKeyJLZRDKDYCZBQBN-UHFFFAOYSA-N
MW227.35 g/mol
LogP3.90
Rot. Bonds4

About 2-methyl-5-naphthalen-1-ylpentan-2-amine

2-methyl-5-naphthalen-1-ylpentan-2-amine (PubChem CID 116925299) has the molecular formula C16H21N and a molecular weight of 227.35 g/mol. Its IUPAC name is 2-methyl-5-naphthalen-1-ylpentan-2-amine.

Molecular Properties

Compound Name2-methyl-5-naphthalen-1-ylpentan-2-amine
PubChem CID116925299
Molecular FormulaC16H21N
Molecular Weight227.35 g/mol
Exact Mass227.17
IUPAC Name2-methyl-5-naphthalen-1-ylpentan-2-amine
SMILESCC(C)(N)CCCc1cccc2ccccc12
InChIInChI=1S/C16H21N/c1-16(2,17)12-6-10-14-9-5-8-13-7-3-4-11-15(13)14/h3-5,7-9,11H,6,10,12,17H2,1-2H3
InChIKeyJLZRDKDYCZBQBN-UHFFFAOYSA-N
XLogP3.90
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-fluorobutyl)naphthalene
CID 174977280
2-methylpropan-2-amine;naphthalen-1-ylmethanamine
CID 142317452
1-butylnaphthalene;ethane
CID 142087052
azane;1-butylnaphthalene;methane
CID 174691035
8-naphthalen-1-yloctan-1-amine
CID 100987116
1-tetradecylnaphthalene
CID 14402128
3-naphthalen-1-ylpropan-1-ol
CID 14711518
methanamine;1-propylnaphthalene
CID 174438724
1-[3-(3-naphthalen-1-ylpropoxy)propyl]naphthalene
CID 139748426
1-(4-methoxybutyl)naphthalene
CID 69278949
potassium;hydride;1-octylnaphthalene
CID 173443599
N-(3-naphthalen-1-ylpropyl)-2-phenylpropan-2-amine
CID 70274234

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-naphthalen-1-ylpentan-2-amine?
The IUPAC name of 2-methyl-5-naphthalen-1-ylpentan-2-amine (CID 116925299) is 2-methyl-5-naphthalen-1-ylpentan-2-amine.
What is the SMILES notation for 2-methyl-5-naphthalen-1-ylpentan-2-amine?
The canonical SMILES for 2-methyl-5-naphthalen-1-ylpentan-2-amine is CC(C)(N)CCCc1cccc2ccccc12.
What is the InChIKey of 2-methyl-5-naphthalen-1-ylpentan-2-amine?
The InChIKey is JLZRDKDYCZBQBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N/c1-16(2,17)12-6-10-14-9-5-8-13-7-3-4-11-15(13)14/h3-5,7-9,11H,6,10,12,17H2,1-2H3.
What are the key properties of 2-methyl-5-naphthalen-1-ylpentan-2-amine?
2-methyl-5-naphthalen-1-ylpentan-2-amine has a molecular weight of 227.35 g/mol, XLogP of 3.90, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-naphthalen-1-ylpentan-2-amine is sourced from PubChem (CID 116925299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).