3-[[(2,2,3,3-tetramethylcyclopropyl)methylamino]methyl]phenol

C15H23NO — CID 79352632

IUPAC3-[[(2,2,3,3-tetramethylcyclopropyl)methylamino]methyl]phenol
SMILESCC1(C)C(CNCc2cccc(O)c2)C1(C)C
InChIInChI=1S/C15H23NO/c1-14(2)13(15(14,3)4)10-16-9-11-6-5-7-12(17)8-11/h5-8,13,16-17H,9-10H2,1-4H3
InChIKeyVXTOLDGCVUWZBG-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.16
Rot. Bonds4

About 3-[[(2,2,3,3-tetramethylcyclopropyl)methylamino]methyl]phenol

3-[[(2,2,3,3-tetramethylcyclopropyl)methylamino]methyl]phenol (PubChem CID 79352632) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 3-[[(2,2,3,3-tetramethylcyclopropyl)methylamino]methyl]phenol.

Molecular Properties

Compound Name3-[[(2,2,3,3-tetramethylcyclopropyl)methylamino]methyl]phenol
PubChem CID79352632
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name3-[[(2,2,3,3-tetramethylcyclopropyl)methylamino]methyl]phenol
SMILESCC1(C)C(CNCc2cccc(O)c2)C1(C)C
InChIInChI=1S/C15H23NO/c1-14(2)13(15(14,3)4)10-16-9-11-6-5-7-12(17)8-11/h5-8,13,16-17H,9-10H2,1-4H3
InChIKeyVXTOLDGCVUWZBG-UHFFFAOYSA-N
XLogP3.16
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(naphthalen-2-ylmethyl)-1-(2,2,3,3-tetramethylcyclopropyl)methanamine
CID 79351410
3-[[(1-methylcyclopropyl)methylamino]methyl]phenol
CID 103724255
3-(propylaminomethyl)phenol
CID 10725714
3-[[2-(ethylamino)ethylamino]methyl]phenol
CID 83962894
3-[(2,2-dimethylpropylamino)methyl]phenol
CID 61168386
3-[(4-methylpentylamino)methyl]phenol
CID 60744251
3-[[(4-methyloxan-4-yl)methylamino]methyl]phenol
CID 103743628
3-[(oxolan-3-ylmethylamino)methyl]phenol
CID 60920792
3-[(2-methylbutylamino)methyl]phenol
CID 62694321
2-fluoro-4-[[(2,2,3,3-tetramethylcyclopropyl)methylamino]methyl]benzoic acid
CID 106700205
3-[(3-cyclopropylpropylamino)methyl]phenol
CID 115639607
3-[(4-methylsulfanylbutylamino)methyl]phenol
CID 115639371

Frequently Asked Questions

What is the IUPAC name of 3-[[(2,2,3,3-tetramethylcyclopropyl)methylamino]methyl]phenol?
The IUPAC name of 3-[[(2,2,3,3-tetramethylcyclopropyl)methylamino]methyl]phenol (CID 79352632) is 3-[[(2,2,3,3-tetramethylcyclopropyl)methylamino]methyl]phenol.
What is the SMILES notation for 3-[[(2,2,3,3-tetramethylcyclopropyl)methylamino]methyl]phenol?
The canonical SMILES for 3-[[(2,2,3,3-tetramethylcyclopropyl)methylamino]methyl]phenol is CC1(C)C(CNCc2cccc(O)c2)C1(C)C.
What is the InChIKey of 3-[[(2,2,3,3-tetramethylcyclopropyl)methylamino]methyl]phenol?
The InChIKey is VXTOLDGCVUWZBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-14(2)13(15(14,3)4)10-16-9-11-6-5-7-12(17)8-11/h5-8,13,16-17H,9-10H2,1-4H3.
What are the key properties of 3-[[(2,2,3,3-tetramethylcyclopropyl)methylamino]methyl]phenol?
3-[[(2,2,3,3-tetramethylcyclopropyl)methylamino]methyl]phenol has a molecular weight of 233.35 g/mol, XLogP of 3.16, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(2,2,3,3-tetramethylcyclopropyl)methylamino]methyl]phenol is sourced from PubChem (CID 79352632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).