2-(2-methyl-N-propylanilino)phenol

C16H19NO — CID 12677144

IUPAC2-(2-methyl-N-propylanilino)phenol
SMILESCCCN(c1ccccc1C)c1ccccc1O
InChIInChI=1S/C16H19NO/c1-3-12-17(14-9-5-4-8-13(14)2)15-10-6-7-11-16(15)18/h4-11,18H,3,12H2,1-2H3
InChIKeyYTBMUBABGCPRNT-UHFFFAOYSA-N
MW241.33 g/mol
LogP4.25
Rot. Bonds4

About 2-(2-methyl-N-propylanilino)phenol

2-(2-methyl-N-propylanilino)phenol (PubChem CID 12677144) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is 2-(2-methyl-N-propylanilino)phenol.

Molecular Properties

Compound Name2-(2-methyl-N-propylanilino)phenol
PubChem CID12677144
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name2-(2-methyl-N-propylanilino)phenol
SMILESCCCN(c1ccccc1C)c1ccccc1O
InChIInChI=1S/C16H19NO/c1-3-12-17(14-9-5-4-8-13(14)2)15-10-6-7-11-16(15)18/h4-11,18H,3,12H2,1-2H3
InChIKeyYTBMUBABGCPRNT-UHFFFAOYSA-N
XLogP4.25
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,2-dimethyl-N-propylaniline
CID 69435269
N-ethyl-N-[2-(ethylaminomethyl)phenyl]-2-methylaniline
CID 43280687
2-(2-methyl-N-propylanilino)acetic acid
CID 83559835
1-N,2-N-bis(2-methylphenyl)-2-N-octylbenzene-1,2-diamine
CID 134866352
2-(dioctadecylamino)phenol
CID 67178725
4-N-(5-chloro-2-methylphenyl)-2,5-dimethyl-1-N-(2-methylphenyl)-1-N,4-N-dioctylbenzene-1,4-diamine
CID 134866313
2-[hexan-2-yl(propyl)amino]phenol
CID 54465777
1-(N-ethyl-2-methylanilino)pentan-2-ol
CID 62041707
2-[[2-(dipropylamino)phenyl]methyl]phenol
CID 174733371
2-[amino(hexyl)amino]phenol
CID 175507997
ethanol;bis(2-methylphenol);titanium
CID 22238726
3-(N-acetyl-2-methylanilino)-N,N-dipropylpropanamide
CID 113123613

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-N-propylanilino)phenol?
The IUPAC name of 2-(2-methyl-N-propylanilino)phenol (CID 12677144) is 2-(2-methyl-N-propylanilino)phenol.
What is the SMILES notation for 2-(2-methyl-N-propylanilino)phenol?
The canonical SMILES for 2-(2-methyl-N-propylanilino)phenol is CCCN(c1ccccc1C)c1ccccc1O.
What is the InChIKey of 2-(2-methyl-N-propylanilino)phenol?
The InChIKey is YTBMUBABGCPRNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-3-12-17(14-9-5-4-8-13(14)2)15-10-6-7-11-16(15)18/h4-11,18H,3,12H2,1-2H3.
What are the key properties of 2-(2-methyl-N-propylanilino)phenol?
2-(2-methyl-N-propylanilino)phenol has a molecular weight of 241.33 g/mol, XLogP of 4.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-N-propylanilino)phenol is sourced from PubChem (CID 12677144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).