N-ethyl-4-(2-methoxyphenyl)-4-methylpentan-2-amine

C15H25NO — CID 64718083

IUPACN-ethyl-4-(2-methoxyphenyl)-4-methylpentan-2-amine
SMILESCCNC(C)CC(C)(C)c1ccccc1OC
InChIInChI=1S/C15H25NO/c1-6-16-12(2)11-15(3,4)13-9-7-8-10-14(13)17-5/h7-10,12,16H,6,11H2,1-5H3
InChIKeyCJHHEBKYVFUXCQ-UHFFFAOYSA-N
MW235.37 g/mol
LogP3.36
Rot. Bonds6

About N-ethyl-4-(2-methoxyphenyl)-4-methylpentan-2-amine

N-ethyl-4-(2-methoxyphenyl)-4-methylpentan-2-amine (PubChem CID 64718083) has the molecular formula C15H25NO and a molecular weight of 235.37 g/mol. Its IUPAC name is N-ethyl-4-(2-methoxyphenyl)-4-methylpentan-2-amine.

Molecular Properties

Compound NameN-ethyl-4-(2-methoxyphenyl)-4-methylpentan-2-amine
PubChem CID64718083
Molecular FormulaC15H25NO
Molecular Weight235.37 g/mol
Exact Mass235.19
IUPAC NameN-ethyl-4-(2-methoxyphenyl)-4-methylpentan-2-amine
SMILESCCNC(C)CC(C)(C)c1ccccc1OC
InChIInChI=1S/C15H25NO/c1-6-16-12(2)11-15(3,4)13-9-7-8-10-14(13)17-5/h7-10,12,16H,6,11H2,1-5H3
InChIKeyCJHHEBKYVFUXCQ-UHFFFAOYSA-N
XLogP3.36
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-bromo-2-methylpentan-2-yl)-2-methoxybenzene
CID 64718135
N-ethyl-4-methyl-4-[2-(trifluoromethyl)phenyl]pentan-2-amine
CID 64715335
1-methoxy-2-(2-methylundecan-2-yl)benzene
CID 56625929
N-ethyl-4-(3-fluoro-4-methoxyphenyl)-4-methylpentan-2-amine
CID 64716592
N-ethyl-3-methoxy-1-(2-methoxyphenyl)-3-methylbutan-1-amine
CID 103024885
1-N-[2-(2-methoxyphenyl)-2-methylpropyl]butane-1,3-diamine
CID 115199750
1-methoxy-2-(2-methoxypropan-2-yl)benzene
CID 58091763
2-(2-methoxyphenyl)-2-methylpropane-1-sulfonyl chloride
CID 82303075
N-ethyl-4-methyl-4-quinolin-5-ylpentan-2-amine
CID 81221548
N-ethyl-1-(2-methoxyphenyl)sulfinylpropan-2-amine
CID 64658239
1-N-[2-(2-methoxyphenyl)-2-methylpropyl]-2-methylpropane-1,2-diamine
CID 115136375
4-(2,4-dimethylphenyl)-N-ethyl-4-methylpentan-2-amine
CID 64717224

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(2-methoxyphenyl)-4-methylpentan-2-amine?
The IUPAC name of N-ethyl-4-(2-methoxyphenyl)-4-methylpentan-2-amine (CID 64718083) is N-ethyl-4-(2-methoxyphenyl)-4-methylpentan-2-amine.
What is the SMILES notation for N-ethyl-4-(2-methoxyphenyl)-4-methylpentan-2-amine?
The canonical SMILES for N-ethyl-4-(2-methoxyphenyl)-4-methylpentan-2-amine is CCNC(C)CC(C)(C)c1ccccc1OC.
What is the InChIKey of N-ethyl-4-(2-methoxyphenyl)-4-methylpentan-2-amine?
The InChIKey is CJHHEBKYVFUXCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO/c1-6-16-12(2)11-15(3,4)13-9-7-8-10-14(13)17-5/h7-10,12,16H,6,11H2,1-5H3.
What are the key properties of N-ethyl-4-(2-methoxyphenyl)-4-methylpentan-2-amine?
N-ethyl-4-(2-methoxyphenyl)-4-methylpentan-2-amine has a molecular weight of 235.37 g/mol, XLogP of 3.36, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(2-methoxyphenyl)-4-methylpentan-2-amine is sourced from PubChem (CID 64718083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).