2-methoxy-6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]phenol

C14H23NO3 — CID 82983294

IUPAC2-methoxy-6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]phenol
SMILESCOc1cccc(CN(C)CCOC(C)C)c1O
InChIInChI=1S/C14H23NO3/c1-11(2)18-9-8-15(3)10-12-6-5-7-13(17-4)14(12)16/h5-7,11,16H,8-10H2,1-4H3
InChIKeySRNAZZAKNQQANG-UHFFFAOYSA-N
MW253.34 g/mol
LogP2.26
Rot. Bonds7

About 2-methoxy-6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]phenol

2-methoxy-6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]phenol (PubChem CID 82983294) has the molecular formula C14H23NO3 and a molecular weight of 253.34 g/mol. Its IUPAC name is 2-methoxy-6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]phenol.

Molecular Properties

Compound Name2-methoxy-6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]phenol
PubChem CID82983294
Molecular FormulaC14H23NO3
Molecular Weight253.34 g/mol
Exact Mass253.17
IUPAC Name2-methoxy-6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]phenol
SMILESCOc1cccc(CN(C)CCOC(C)C)c1O
InChIInChI=1S/C14H23NO3/c1-11(2)18-9-8-15(3)10-12-6-5-7-13(17-4)14(12)16/h5-7,11,16H,8-10H2,1-4H3
InChIKeySRNAZZAKNQQANG-UHFFFAOYSA-N
XLogP2.26
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.34
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

2-bromo-6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]phenol
CID 82982903
2-[(2-hydroxy-3-methoxyphenyl)methyl-methylamino]acetic acid
CID 65056423
2-methoxy-5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]phenol
CID 79310118
4-methoxy-3-[[methyl(2-propan-2-yloxyethyl)amino]methyl]benzaldehyde
CID 81057200
2-[(2-hydroxy-3-methoxyphenyl)methyl-methylamino]-N-(2-methoxyethyl)acetamide
CID 82979091
N-methyl-N-[[2-(methylaminomethyl)phenyl]methyl]-2-propan-2-yloxyethanamine
CID 81067280
4-fluoro-2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]aniline
CID 81059061
2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]benzohydrazide
CID 81068442
2-ethoxy-6-[[3-methoxypropyl(methyl)amino]methyl]phenol
CID 82980151
2-[[methyl(2-propan-2-yloxyethyl)amino]methyl]-6-nitrobenzoic acid
CID 104825999
2-[2-(dimethylamino)ethyl-[(2-hydroxy-3-methoxyphenyl)methyl]amino]acetic acid
CID 107426429
N-[[3-(aminomethyl)-4-methoxyphenyl]methyl]-N-methyl-2-propan-2-yloxyethanamine
CID 81058780

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]phenol?
The IUPAC name of 2-methoxy-6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]phenol (CID 82983294) is 2-methoxy-6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]phenol.
What is the SMILES notation for 2-methoxy-6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]phenol?
The canonical SMILES for 2-methoxy-6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]phenol is COc1cccc(CN(C)CCOC(C)C)c1O.
What is the InChIKey of 2-methoxy-6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]phenol?
The InChIKey is SRNAZZAKNQQANG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO3/c1-11(2)18-9-8-15(3)10-12-6-5-7-13(17-4)14(12)16/h5-7,11,16H,8-10H2,1-4H3.
What are the key properties of 2-methoxy-6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]phenol?
2-methoxy-6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]phenol has a molecular weight of 253.34 g/mol, XLogP of 2.26, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6-[[methyl(2-propan-2-yloxyethyl)amino]methyl]phenol is sourced from PubChem (CID 82983294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).