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

C19H27NO — CID 105130911

IUPACN-ethyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine
SMILESCCNC(COC(C)(C)C)Cc1cccc2ccccc12
InChIInChI=1S/C19H27NO/c1-5-20-17(14-21-19(2,3)4)13-16-11-8-10-15-9-6-7-12-18(15)16/h6-12,17,20H,5,13-14H2,1-4H3
InChIKeyDAOPMWYBILBNLL-UHFFFAOYSA-N
MW285.43 g/mol
LogP4.18
Rot. Bonds6

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

N-ethyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine (PubChem CID 105130911) has the molecular formula C19H27NO and a molecular weight of 285.43 g/mol. Its IUPAC name is N-ethyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine
PubChem CID105130911
Molecular FormulaC19H27NO
Molecular Weight285.43 g/mol
Exact Mass285.21
IUPAC NameN-ethyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine
SMILESCCNC(COC(C)(C)C)Cc1cccc2ccccc12
InChIInChI=1S/C19H27NO/c1-5-20-17(14-21-19(2,3)4)13-16-11-8-10-15-9-6-7-12-18(15)16/h6-12,17,20H,5,13-14H2,1-4H3
InChIKeyDAOPMWYBILBNLL-UHFFFAOYSA-N
XLogP4.18
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.43
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine
CID 105130965
1-(2-bromophenyl)-N-ethyl-3-[(2-methylpropan-2-yl)oxy]propan-2-amine
CID 105087369
1-(2-chloro-3-fluorophenyl)-N-ethyl-3-[(2-methylpropan-2-yl)oxy]propan-2-amine
CID 105178828
1-(2-bromo-3-fluorophenyl)-N-ethyl-3-[(2-methylpropan-2-yl)oxy]propan-2-amine
CID 105172034
1-methoxy-3-naphthalen-1-yl-N-propylpropan-2-amine
CID 55095273
N-ethyl-1-naphthalen-1-ylhept-6-yn-2-amine
CID 105179696
(1-naphthalen-1-yl-3-propoxypropan-2-yl)hydrazine
CID 105210084
1-(2,2-diethoxyethyl)naphthalene
CID 146004800
[1-(2-methylphenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine
CID 105285289
1-(2,2-dimethylpropyl)naphthalene;methane
CID 145304916
[1-(2-methoxyphenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine
CID 105289511
2-(ethylamino)-3-[(2-methylpropan-2-yl)oxy]propan-1-ol
CID 64802946

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine?
The IUPAC name of N-ethyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine (CID 105130911) is N-ethyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine.
What is the SMILES notation for N-ethyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine?
The canonical SMILES for N-ethyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine is CCNC(COC(C)(C)C)Cc1cccc2ccccc12.
What is the InChIKey of N-ethyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine?
The InChIKey is DAOPMWYBILBNLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27NO/c1-5-20-17(14-21-19(2,3)4)13-16-11-8-10-15-9-6-7-12-18(15)16/h6-12,17,20H,5,13-14H2,1-4H3.
What are the key properties of N-ethyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine?
N-ethyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine has a molecular weight of 285.43 g/mol, XLogP of 4.18, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[(2-methylpropan-2-yl)oxy]-3-naphthalen-1-ylpropan-2-amine is sourced from PubChem (CID 105130911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).