N-methyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine

C18H25NO — CID 105130965

IUPACN-methyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine
SMILESCNC(COC(C)(C)C)Cc1cccc2ccccc12
InChIInChI=1S/C18H25NO/c1-18(2,3)20-13-16(19-4)12-15-10-7-9-14-8-5-6-11-17(14)15/h5-11,16,19H,12-13H2,1-4H3
InChIKeyOFBQPKDTJPLUCO-UHFFFAOYSA-N
MW271.40 g/mol
LogP3.79
Rot. Bonds5

About N-methyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine

N-methyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine (PubChem CID 105130965) has the molecular formula C18H25NO and a molecular weight of 271.40 g/mol. Its IUPAC name is N-methyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine.

Molecular Properties

Compound NameN-methyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine
PubChem CID105130965
Molecular FormulaC18H25NO
Molecular Weight271.40 g/mol
Exact Mass271.19
IUPAC NameN-methyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine
SMILESCNC(COC(C)(C)C)Cc1cccc2ccccc12
InChIInChI=1S/C18H25NO/c1-18(2,3)20-13-16(19-4)12-15-10-7-9-14-8-5-6-11-17(14)15/h5-11,16,19H,12-13H2,1-4H3
InChIKeyOFBQPKDTJPLUCO-UHFFFAOYSA-N
XLogP3.79
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine
CID 105130911
N-methyl-1-[(2-methylpropan-2-yl)oxy]-3-phenylpropan-2-amine
CID 105084518
(2R)-N-methyl-1-naphthalen-1-ylpropan-2-amine
CID 142942326
[1-(2-methylphenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine
CID 105285289
1-methoxy-3-(7-methoxynaphthalen-1-yl)-N-methylpropan-2-amine
CID 115506270
4-(furan-2-yl)-N-methyl-1-naphthalen-1-ylbutan-2-amine
CID 61078586
1-methoxy-3-naphthalen-1-yl-N-propylpropan-2-amine
CID 55095273
1-(2-bromophenyl)-N-ethyl-3-[(2-methylpropan-2-yl)oxy]propan-2-amine
CID 105087369
(1-naphthalen-1-yl-3-propoxypropan-2-yl)hydrazine
CID 105210084
[1-(2-methoxyphenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine
CID 105289511
1-(2,2-diethoxyethyl)naphthalene
CID 146004800
N,4-dimethyl-3-(naphthalen-1-ylmethyl)pentan-2-amine
CID 62916002

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine?
The IUPAC name of N-methyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine (CID 105130965) is N-methyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine.
What is the SMILES notation for N-methyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine?
The canonical SMILES for N-methyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine is CNC(COC(C)(C)C)Cc1cccc2ccccc12.
What is the InChIKey of N-methyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine?
The InChIKey is OFBQPKDTJPLUCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25NO/c1-18(2,3)20-13-16(19-4)12-15-10-7-9-14-8-5-6-11-17(14)15/h5-11,16,19H,12-13H2,1-4H3.
What are the key properties of N-methyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine?
N-methyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine has a molecular weight of 271.40 g/mol, XLogP of 3.79, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine is sourced from PubChem (CID 105130965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).