N-(4-methoxyphenyl)-3,5-dimethyl-N-propan-2-ylaniline

C18H23NO — CID 59308365

IUPACN-(4-methoxyphenyl)-3,5-dimethyl-N-propan-2-ylaniline
SMILESCOc1ccc(N(c2cc(C)cc(C)c2)C(C)C)cc1
InChIInChI=1S/C18H23NO/c1-13(2)19(16-6-8-18(20-5)9-7-16)17-11-14(3)10-15(4)12-17/h6-13H,1-5H3
InChIKeyUSTCOUJJPCSJCH-UHFFFAOYSA-N
MW269.39 g/mol
LogP4.86
Rot. Bonds4

About N-(4-methoxyphenyl)-3,5-dimethyl-N-propan-2-ylaniline

N-(4-methoxyphenyl)-3,5-dimethyl-N-propan-2-ylaniline (PubChem CID 59308365) has the molecular formula C18H23NO and a molecular weight of 269.39 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-3,5-dimethyl-N-propan-2-ylaniline.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-3,5-dimethyl-N-propan-2-ylaniline
PubChem CID59308365
Molecular FormulaC18H23NO
Molecular Weight269.39 g/mol
Exact Mass269.18
IUPAC NameN-(4-methoxyphenyl)-3,5-dimethyl-N-propan-2-ylaniline
SMILESCOc1ccc(N(c2cc(C)cc(C)c2)C(C)C)cc1
InChIInChI=1S/C18H23NO/c1-13(2)19(16-6-8-18(20-5)9-7-16)17-11-14(3)10-15(4)12-17/h6-13H,1-5H3
InChIKeyUSTCOUJJPCSJCH-UHFFFAOYSA-N
XLogP4.86
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,4-dimethoxy-N-(4-methylphenyl)-N-propan-2-ylaniline
CID 177401389
N-(3,5-dimethylphenyl)-4-methoxy-N-methylbenzenesulfonamide
CID 94622750
N-(4-methoxyphenyl)-N,3-dimethylaniline
CID 58090553
1-(3,5-dimethylphenyl)-1-(4-methoxyphenyl)-N-methylmethanamine
CID 43481665
1-N,1-N,4-N,4-N-tetrakis(4-methoxyphenyl)benzene-1,4-diamine
CID 18996647
(2R)-N-(3,5-dimethylphenyl)-2-(4-methoxy-N-methylsulfonylanilino)propanamide
CID 1131201
1-(113C)methoxy-4-methylbenzene
CID 166176950
1-N,4-N-bis[4-(4-methoxy-N-(3-methylphenyl)anilino)phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine
CID 59738736
N-[4-[4-[4-(4-methoxy-N-(4-methoxyphenyl)anilino)phenyl]phenyl]phenyl]-4-methyl-N-(4-methylphenyl)aniline
CID 130397287
ethane;1-methoxy-4-methylbenzene;N,N,4-trimethylaniline
CID 142497579
1-(4-methoxyphenyl)-1-(4-methylphenyl)hydrazine
CID 66898674
dipropan-2-yl 2-(N-(4-fluoro-3,5-dimethylphenyl)-4-methoxyanilino)propanedioate
CID 135382362

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-3,5-dimethyl-N-propan-2-ylaniline?
The IUPAC name of N-(4-methoxyphenyl)-3,5-dimethyl-N-propan-2-ylaniline (CID 59308365) is N-(4-methoxyphenyl)-3,5-dimethyl-N-propan-2-ylaniline.
What is the SMILES notation for N-(4-methoxyphenyl)-3,5-dimethyl-N-propan-2-ylaniline?
The canonical SMILES for N-(4-methoxyphenyl)-3,5-dimethyl-N-propan-2-ylaniline is COc1ccc(N(c2cc(C)cc(C)c2)C(C)C)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-3,5-dimethyl-N-propan-2-ylaniline?
The InChIKey is USTCOUJJPCSJCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO/c1-13(2)19(16-6-8-18(20-5)9-7-16)17-11-14(3)10-15(4)12-17/h6-13H,1-5H3.
What are the key properties of N-(4-methoxyphenyl)-3,5-dimethyl-N-propan-2-ylaniline?
N-(4-methoxyphenyl)-3,5-dimethyl-N-propan-2-ylaniline has a molecular weight of 269.39 g/mol, XLogP of 4.86, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-3,5-dimethyl-N-propan-2-ylaniline is sourced from PubChem (CID 59308365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).