N-methyl-1-naphthalen-2-yloxybutan-2-amine

C15H19NO — CID 62041246

IUPACN-methyl-1-naphthalen-2-yloxybutan-2-amine
SMILESCCC(COc1ccc2ccccc2c1)NC
InChIInChI=1S/C15H19NO/c1-3-14(16-2)11-17-15-9-8-12-6-4-5-7-13(12)10-15/h4-10,14,16H,3,11H2,1-2H3
InChIKeyPYFLQJKMXXERGX-UHFFFAOYSA-N
MW229.32 g/mol
LogP3.22
Rot. Bonds5

About N-methyl-1-naphthalen-2-yloxybutan-2-amine

N-methyl-1-naphthalen-2-yloxybutan-2-amine (PubChem CID 62041246) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is N-methyl-1-naphthalen-2-yloxybutan-2-amine.

Molecular Properties

Compound NameN-methyl-1-naphthalen-2-yloxybutan-2-amine
PubChem CID62041246
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC NameN-methyl-1-naphthalen-2-yloxybutan-2-amine
SMILESCCC(COc1ccc2ccccc2c1)NC
InChIInChI=1S/C15H19NO/c1-3-14(16-2)11-17-15-9-8-12-6-4-5-7-13(12)10-15/h4-10,14,16H,3,11H2,1-2H3
InChIKeyPYFLQJKMXXERGX-UHFFFAOYSA-N
XLogP3.22
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-(3-methylphenoxy)butan-2-amine
CID 62038283
1-(4-ethylphenoxy)-N-methylbutan-2-amine
CID 62038493
N,2-dimethyl-3-naphthalen-2-yloxypropan-1-amine
CID 62459950
3-naphthalen-2-yloxy-2-(propan-2-ylamino)propan-1-ol
CID 64803525
N,N-dimethyl-1-naphthalen-2-yloxypropan-2-amine
CID 4189894
(2R)-1-(methylamino)-3-naphthalen-2-yloxypropan-2-ol
CID 1132897
2-naphthalen-2-yloxy-N-pentan-3-ylacetamide
CID 24951700
2-ethoxynaphthalene
CID 118978197
1-naphthalen-2-yloxypropan-2-ol
CID 2793897
1-cyclohexyl-N-methyl-2-naphthalen-2-yloxyethanamine
CID 104748601
1-(3,5-difluorophenoxy)-N-methylbutan-2-amine
CID 62786158
2-(2-methoxypropoxy)naphthalene
CID 155439775

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-naphthalen-2-yloxybutan-2-amine?
The IUPAC name of N-methyl-1-naphthalen-2-yloxybutan-2-amine (CID 62041246) is N-methyl-1-naphthalen-2-yloxybutan-2-amine.
What is the SMILES notation for N-methyl-1-naphthalen-2-yloxybutan-2-amine?
The canonical SMILES for N-methyl-1-naphthalen-2-yloxybutan-2-amine is CCC(COc1ccc2ccccc2c1)NC.
What is the InChIKey of N-methyl-1-naphthalen-2-yloxybutan-2-amine?
The InChIKey is PYFLQJKMXXERGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO/c1-3-14(16-2)11-17-15-9-8-12-6-4-5-7-13(12)10-15/h4-10,14,16H,3,11H2,1-2H3.
What are the key properties of N-methyl-1-naphthalen-2-yloxybutan-2-amine?
N-methyl-1-naphthalen-2-yloxybutan-2-amine has a molecular weight of 229.32 g/mol, XLogP of 3.22, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-naphthalen-2-yloxybutan-2-amine is sourced from PubChem (CID 62041246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).