2-methyl-5-[(1-methylpiperidin-2-yl)methylamino]phenol

C14H22N2O — CID 107700090

IUPAC2-methyl-5-[(1-methylpiperidin-2-yl)methylamino]phenol
SMILESCc1ccc(NCC2CCCCN2C)cc1O
InChIInChI=1S/C14H22N2O/c1-11-6-7-12(9-14(11)17)15-10-13-5-3-4-8-16(13)2/h6-7,9,13,15,17H,3-5,8,10H2,1-2H3
InChIKeyFTCWOTDIEVLIAA-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.60
Rot. Bonds3

About 2-methyl-5-[(1-methylpiperidin-2-yl)methylamino]phenol

2-methyl-5-[(1-methylpiperidin-2-yl)methylamino]phenol (PubChem CID 107700090) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-methyl-5-[(1-methylpiperidin-2-yl)methylamino]phenol.

Molecular Properties

Compound Name2-methyl-5-[(1-methylpiperidin-2-yl)methylamino]phenol
PubChem CID107700090
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name2-methyl-5-[(1-methylpiperidin-2-yl)methylamino]phenol
SMILESCc1ccc(NCC2CCCCN2C)cc1O
InChIInChI=1S/C14H22N2O/c1-11-6-7-12(9-14(11)17)15-10-13-5-3-4-8-16(13)2/h6-7,9,13,15,17H,3-5,8,10H2,1-2H3
InChIKeyFTCWOTDIEVLIAA-UHFFFAOYSA-N
XLogP2.60
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-4-[(1-methylpiperidin-2-yl)methylamino]phenol
CID 107678243
5-(cycloheptylmethylamino)-2-methylphenol
CID 107699720
2-chloro-5-[(1-methylpiperidin-2-yl)methylamino]benzoic acid
CID 62657718
3,4-dichloro-N-[(1-methylpyrrolidin-2-yl)methyl]aniline
CID 83962864
3-iodo-N-[(1-methylpiperidin-2-yl)methyl]aniline
CID 62655252
tert-butyl 2-[(3-hydroxy-4-methylanilino)methyl]pyrrolidine-1-carboxylate
CID 107700259
4-cyclopentyloxy-N-[(1-methylpiperidin-2-yl)methyl]aniline
CID 62656703
4-cyclopentylsulfanyl-N-[(1-methylpiperidin-2-yl)methyl]aniline
CID 63445652
N,N-dimethyl-4-[(1-methylpiperidin-2-yl)methylamino]benzamide
CID 62655654
2,5-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]aniline
CID 83962534
4-iodo-2-methyl-N-[(1-methylpiperidin-2-yl)methyl]aniline
CID 55099801
4-methyl-3-[(1-methylpiperidin-2-yl)methylamino]benzonitrile
CID 62658328

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-[(1-methylpiperidin-2-yl)methylamino]phenol?
The IUPAC name of 2-methyl-5-[(1-methylpiperidin-2-yl)methylamino]phenol (CID 107700090) is 2-methyl-5-[(1-methylpiperidin-2-yl)methylamino]phenol.
What is the SMILES notation for 2-methyl-5-[(1-methylpiperidin-2-yl)methylamino]phenol?
The canonical SMILES for 2-methyl-5-[(1-methylpiperidin-2-yl)methylamino]phenol is Cc1ccc(NCC2CCCCN2C)cc1O.
What is the InChIKey of 2-methyl-5-[(1-methylpiperidin-2-yl)methylamino]phenol?
The InChIKey is FTCWOTDIEVLIAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-11-6-7-12(9-14(11)17)15-10-13-5-3-4-8-16(13)2/h6-7,9,13,15,17H,3-5,8,10H2,1-2H3.
What are the key properties of 2-methyl-5-[(1-methylpiperidin-2-yl)methylamino]phenol?
2-methyl-5-[(1-methylpiperidin-2-yl)methylamino]phenol has a molecular weight of 234.34 g/mol, XLogP of 2.60, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-[(1-methylpiperidin-2-yl)methylamino]phenol is sourced from PubChem (CID 107700090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).