2-methoxy-2-methyl-1-naphthalen-2-yl-N-propylpropan-1-amine

C18H25NO — CID 79196999

IUPAC2-methoxy-2-methyl-1-naphthalen-2-yl-N-propylpropan-1-amine
SMILESCCCNC(c1ccc2ccccc2c1)C(C)(C)OC
InChIInChI=1S/C18H25NO/c1-5-12-19-17(18(2,3)20-4)16-11-10-14-8-6-7-9-15(14)13-16/h6-11,13,17,19H,5,12H2,1-4H3
InChIKeyDDFOZMMGANZFBQ-UHFFFAOYSA-N
MW271.40 g/mol
LogP4.31
Rot. Bonds6

About 2-methoxy-2-methyl-1-naphthalen-2-yl-N-propylpropan-1-amine

2-methoxy-2-methyl-1-naphthalen-2-yl-N-propylpropan-1-amine (PubChem CID 79196999) has the molecular formula C18H25NO and a molecular weight of 271.40 g/mol. Its IUPAC name is 2-methoxy-2-methyl-1-naphthalen-2-yl-N-propylpropan-1-amine.

Molecular Properties

Compound Name2-methoxy-2-methyl-1-naphthalen-2-yl-N-propylpropan-1-amine
PubChem CID79196999
Molecular FormulaC18H25NO
Molecular Weight271.40 g/mol
Exact Mass271.19
IUPAC Name2-methoxy-2-methyl-1-naphthalen-2-yl-N-propylpropan-1-amine
SMILESCCCNC(c1ccc2ccccc2c1)C(C)(C)OC
InChIInChI=1S/C18H25NO/c1-5-12-19-17(18(2,3)20-4)16-11-10-14-8-6-7-9-15(14)13-16/h6-11,13,17,19H,5,12H2,1-4H3
InChIKeyDDFOZMMGANZFBQ-UHFFFAOYSA-N
XLogP4.31
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dimethyl-1-naphthalen-2-yl-N-propylpropan-1-amine
CID 63413588
2,2-dimethyl-1-naphthalen-2-yl-N-propylbutan-1-amine
CID 115851112
N,2-diethyl-2-methoxy-1-naphthalen-2-ylbutan-1-amine
CID 116761218
2-methoxy-1-naphthalen-2-yl-N-propylpropan-1-amine
CID 79616716
2-methoxy-2-methyl-1-(6-methyl-3-pyridinyl)-N-propylpropan-1-amine
CID 79198511
3-naphthalen-2-yl-N-propylbutan-2-amine
CID 66437220
1-(2-chlorophenyl)-2-methoxy-2-methyl-N-propylpropan-1-amine
CID 79196771
2-methoxy-2-methyl-1-naphthalen-2-ylpropan-1-ol
CID 79196831
2-methoxy-2-methyl-1-naphthalen-2-ylpropan-1-amine
CID 79197880
2-naphthalen-2-yl-2-(propylamino)ethanol
CID 61055183
1-(3-fluoro-5-methylphenyl)-2-methoxy-2-methyl-N-propylpropan-1-amine
CID 79705438
N-[naphthalen-2-yl(pyridin-2-yl)methyl]propan-1-amine
CID 62790514

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-2-methyl-1-naphthalen-2-yl-N-propylpropan-1-amine?
The IUPAC name of 2-methoxy-2-methyl-1-naphthalen-2-yl-N-propylpropan-1-amine (CID 79196999) is 2-methoxy-2-methyl-1-naphthalen-2-yl-N-propylpropan-1-amine.
What is the SMILES notation for 2-methoxy-2-methyl-1-naphthalen-2-yl-N-propylpropan-1-amine?
The canonical SMILES for 2-methoxy-2-methyl-1-naphthalen-2-yl-N-propylpropan-1-amine is CCCNC(c1ccc2ccccc2c1)C(C)(C)OC.
What is the InChIKey of 2-methoxy-2-methyl-1-naphthalen-2-yl-N-propylpropan-1-amine?
The InChIKey is DDFOZMMGANZFBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25NO/c1-5-12-19-17(18(2,3)20-4)16-11-10-14-8-6-7-9-15(14)13-16/h6-11,13,17,19H,5,12H2,1-4H3.
What are the key properties of 2-methoxy-2-methyl-1-naphthalen-2-yl-N-propylpropan-1-amine?
2-methoxy-2-methyl-1-naphthalen-2-yl-N-propylpropan-1-amine has a molecular weight of 271.40 g/mol, XLogP of 4.31, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2-methyl-1-naphthalen-2-yl-N-propylpropan-1-amine is sourced from PubChem (CID 79196999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).