5-methyl-N-(2-naphthalen-1-yloxyethyl)hexan-2-amine

C19H27NO — CID 63505261

IUPAC5-methyl-N-(2-naphthalen-1-yloxyethyl)hexan-2-amine
SMILESCC(C)CCC(C)NCCOc1cccc2ccccc12
InChIInChI=1S/C19H27NO/c1-15(2)11-12-16(3)20-13-14-21-19-10-6-8-17-7-4-5-9-18(17)19/h4-10,15-16,20H,11-14H2,1-3H3
InChIKeyTUZBUUBONIYNDP-UHFFFAOYSA-N
MW285.43 g/mol
LogP4.63
Rot. Bonds8

About 5-methyl-N-(2-naphthalen-1-yloxyethyl)hexan-2-amine

5-methyl-N-(2-naphthalen-1-yloxyethyl)hexan-2-amine (PubChem CID 63505261) has the molecular formula C19H27NO and a molecular weight of 285.43 g/mol. Its IUPAC name is 5-methyl-N-(2-naphthalen-1-yloxyethyl)hexan-2-amine.

Molecular Properties

Compound Name5-methyl-N-(2-naphthalen-1-yloxyethyl)hexan-2-amine
PubChem CID63505261
Molecular FormulaC19H27NO
Molecular Weight285.43 g/mol
Exact Mass285.21
IUPAC Name5-methyl-N-(2-naphthalen-1-yloxyethyl)hexan-2-amine
SMILESCC(C)CCC(C)NCCOc1cccc2ccccc12
InChIInChI=1S/C19H27NO/c1-15(2)11-12-16(3)20-13-14-21-19-10-6-8-17-7-4-5-9-18(17)19/h4-10,15-16,20H,11-14H2,1-3H3
InChIKeyTUZBUUBONIYNDP-UHFFFAOYSA-N
XLogP4.63
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.43
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(4-methylpentoxy)naphthalene
CID 83168126
(1S)-N-(2-naphthalen-1-yloxyethyl)-1-phenylethanamine
CID 2183529
N-[2-(2,6-dibromophenoxy)ethyl]-5-methylhexan-2-amine
CID 63505607
3-naphthalen-1-yloxy-N-[(1S)-1-phenylethyl]propan-1-amine
CID 2183626
2-[2-(pentan-2-ylamino)ethoxy]aniline
CID 107886628
(2S)-2-amino-4-methyl-N-(2-naphthalen-1-yloxyethyl)pentanamide
CID 119738781
5-methyl-N-[2-(5-methyl-2-propan-2-ylphenoxy)ethyl]hexan-2-amine
CID 63504935
2-[(5-methyl-1-naphthalen-1-yloxyhexan-2-yl)disulfanyl]-3-naphthalen-1-yloxy-N-propan-2-ylpropan-1-amine
CID 162023104
2-(ethylamino)-4-naphthalen-1-yloxybutan-1-ol
CID 22754998
N',N'-dimethyl-N-(3-naphthalen-1-yloxypropyl)propane-1,3-diamine
CID 2182334
5-methyl-N-[2-(4-methylsulfanylphenoxy)ethyl]hexan-2-amine
CID 55245786
1-butoxynaphthalene
CID 13262700

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(2-naphthalen-1-yloxyethyl)hexan-2-amine?
The IUPAC name of 5-methyl-N-(2-naphthalen-1-yloxyethyl)hexan-2-amine (CID 63505261) is 5-methyl-N-(2-naphthalen-1-yloxyethyl)hexan-2-amine.
What is the SMILES notation for 5-methyl-N-(2-naphthalen-1-yloxyethyl)hexan-2-amine?
The canonical SMILES for 5-methyl-N-(2-naphthalen-1-yloxyethyl)hexan-2-amine is CC(C)CCC(C)NCCOc1cccc2ccccc12.
What is the InChIKey of 5-methyl-N-(2-naphthalen-1-yloxyethyl)hexan-2-amine?
The InChIKey is TUZBUUBONIYNDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27NO/c1-15(2)11-12-16(3)20-13-14-21-19-10-6-8-17-7-4-5-9-18(17)19/h4-10,15-16,20H,11-14H2,1-3H3.
What are the key properties of 5-methyl-N-(2-naphthalen-1-yloxyethyl)hexan-2-amine?
5-methyl-N-(2-naphthalen-1-yloxyethyl)hexan-2-amine has a molecular weight of 285.43 g/mol, XLogP of 4.63, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-naphthalen-1-yloxyethyl)hexan-2-amine is sourced from PubChem (CID 63505261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).