N-ethyl-4-methyl-2-phenoxy-1,2,3,4-tetrahydronaphthalen-1-amine

C19H23NO — CID 115419175

IUPACN-ethyl-4-methyl-2-phenoxy-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCNC1c2ccccc2C(C)CC1Oc1ccccc1
InChIInChI=1S/C19H23NO/c1-3-20-19-17-12-8-7-11-16(17)14(2)13-18(19)21-15-9-5-4-6-10-15/h4-12,14,18-20H,3,13H2,1-2H3
InChIKeyBKDBXVKVIMREOM-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.29
Rot. Bonds4

About N-ethyl-4-methyl-2-phenoxy-1,2,3,4-tetrahydronaphthalen-1-amine

N-ethyl-4-methyl-2-phenoxy-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 115419175) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is N-ethyl-4-methyl-2-phenoxy-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound NameN-ethyl-4-methyl-2-phenoxy-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID115419175
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC NameN-ethyl-4-methyl-2-phenoxy-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCNC1c2ccccc2C(C)CC1Oc1ccccc1
InChIInChI=1S/C19H23NO/c1-3-20-19-17-12-8-7-11-16(17)14(2)13-18(19)21-15-9-5-4-6-10-15/h4-12,14,18-20H,3,13H2,1-2H3
InChIKeyBKDBXVKVIMREOM-UHFFFAOYSA-N
XLogP4.29
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-4-methyl-2-phenylsulfanyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115420483
N-ethyl-4-methyl-2-(3-methylpyrrolidin-1-yl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115418929
2-N-butyl-1-N-ethyl-2-N,4-dimethyl-1,2,3,4-tetrahydronaphthalene-1,2-diamine
CID 115418822
N-ethyl-4-methyl-2-propylsulfonyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115420263
N-ethyl-4-methyl-2-pyrazol-1-yl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115419104
2-(1-methoxypropan-2-yloxy)-4-methyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115419271
2-cyclopentylsulfinyl-N-ethyl-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115420341
2-butylsulfinyl-N-ethyl-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115420327
2-butan-2-ylsulfinyl-N-ethyl-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115420303
4-methyl-2-(3-methylphenoxy)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115420154
4-methyl-2-(4-methylphenoxy)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115419182
4-tert-butyl-N-ethyl-2-phenoxycyclohexan-1-amine
CID 63474712

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methyl-2-phenoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of N-ethyl-4-methyl-2-phenoxy-1,2,3,4-tetrahydronaphthalen-1-amine (CID 115419175) is N-ethyl-4-methyl-2-phenoxy-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for N-ethyl-4-methyl-2-phenoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for N-ethyl-4-methyl-2-phenoxy-1,2,3,4-tetrahydronaphthalen-1-amine is CCNC1c2ccccc2C(C)CC1Oc1ccccc1.
What is the InChIKey of N-ethyl-4-methyl-2-phenoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is BKDBXVKVIMREOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-3-20-19-17-12-8-7-11-16(17)14(2)13-18(19)21-15-9-5-4-6-10-15/h4-12,14,18-20H,3,13H2,1-2H3.
What are the key properties of N-ethyl-4-methyl-2-phenoxy-1,2,3,4-tetrahydronaphthalen-1-amine?
N-ethyl-4-methyl-2-phenoxy-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 281.40 g/mol, XLogP of 4.29, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methyl-2-phenoxy-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 115419175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).