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

C17H23NO — CID 62354633

IUPACN-ethyl-2-methyl-2-naphthalen-1-yloxybutan-1-amine
SMILESCCNCC(C)(CC)Oc1cccc2ccccc12
InChIInChI=1S/C17H23NO/c1-4-17(3,13-18-5-2)19-16-12-8-10-14-9-6-7-11-15(14)16/h6-12,18H,4-5,13H2,1-3H3
InChIKeyRPUIREAWIJNFKL-UHFFFAOYSA-N
MW257.38 g/mol
LogP4.00
Rot. Bonds6

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

N-ethyl-2-methyl-2-naphthalen-1-yloxybutan-1-amine (PubChem CID 62354633) has the molecular formula C17H23NO and a molecular weight of 257.38 g/mol. Its IUPAC name is N-ethyl-2-methyl-2-naphthalen-1-yloxybutan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-methyl-2-naphthalen-1-yloxybutan-1-amine
PubChem CID62354633
Molecular FormulaC17H23NO
Molecular Weight257.38 g/mol
Exact Mass257.18
IUPAC NameN-ethyl-2-methyl-2-naphthalen-1-yloxybutan-1-amine
SMILESCCNCC(C)(CC)Oc1cccc2ccccc12
InChIInChI=1S/C17H23NO/c1-4-17(3,13-18-5-2)19-16-12-8-10-14-9-6-7-11-15(14)16/h6-12,18H,4-5,13H2,1-3H3
InChIKeyRPUIREAWIJNFKL-UHFFFAOYSA-N
XLogP4.00
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-tert-butylphenoxy)-N-ethyl-2-methylbutan-1-amine
CID 55195033
N-ethyl-2-(2-methoxyphenoxy)-2-methylbutan-1-amine
CID 62354236
N-ethyl-2-methyl-2-(2-propan-2-ylphenoxy)butan-1-amine
CID 62355451
N-ethyl-2,2-dimethyl-3-naphthalen-1-yloxypropan-1-amine
CID 79626722
2-(2,5-difluorophenoxy)-N-ethyl-2-methylbutan-1-amine
CID 63273363
N-ethyl-2-methyl-3-naphthalen-1-yloxypropan-1-amine
CID 62460664
2-methyl-N-propyl-2-quinolin-8-yloxybutan-1-amine
CID 62353249
1-(1-naphthalen-1-yloxy-1-phenylethoxy)naphthalene
CID 139725351
N-ethyl-2-methyl-2-phenylmethoxybutan-1-amine
CID 62353232
N-ethyl-3-methyl-2-naphthalen-1-yloxybutan-1-amine
CID 62459225
N-ethyl-2-methyl-2-(4-propan-2-ylphenoxy)butan-1-amine
CID 62353237
1-[dibromo(methoxy)methoxy]naphthalene
CID 168966403

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-2-naphthalen-1-yloxybutan-1-amine?
The IUPAC name of N-ethyl-2-methyl-2-naphthalen-1-yloxybutan-1-amine (CID 62354633) is N-ethyl-2-methyl-2-naphthalen-1-yloxybutan-1-amine.
What is the SMILES notation for N-ethyl-2-methyl-2-naphthalen-1-yloxybutan-1-amine?
The canonical SMILES for N-ethyl-2-methyl-2-naphthalen-1-yloxybutan-1-amine is CCNCC(C)(CC)Oc1cccc2ccccc12.
What is the InChIKey of N-ethyl-2-methyl-2-naphthalen-1-yloxybutan-1-amine?
The InChIKey is RPUIREAWIJNFKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO/c1-4-17(3,13-18-5-2)19-16-12-8-10-14-9-6-7-11-15(14)16/h6-12,18H,4-5,13H2,1-3H3.
What are the key properties of N-ethyl-2-methyl-2-naphthalen-1-yloxybutan-1-amine?
N-ethyl-2-methyl-2-naphthalen-1-yloxybutan-1-amine has a molecular weight of 257.38 g/mol, XLogP of 4.00, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-2-naphthalen-1-yloxybutan-1-amine is sourced from PubChem (CID 62354633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).