[4-[[(2,3-dimethyloxolan-3-yl)amino]methyl]phenyl]methanol

C14H21NO2 — CID 103581420

IUPAC[4-[[(2,3-dimethyloxolan-3-yl)amino]methyl]phenyl]methanol
SMILESCC1OCCC1(C)NCc1ccc(CO)cc1
InChIInChI=1S/C14H21NO2/c1-11-14(2,7-8-17-11)15-9-12-3-5-13(10-16)6-4-12/h3-6,11,15-16H,7-10H2,1-2H3
InChIKeyGSLFEWWSEXTDIO-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.84
Rot. Bonds4

About [4-[[(2,3-dimethyloxolan-3-yl)amino]methyl]phenyl]methanol

[4-[[(2,3-dimethyloxolan-3-yl)amino]methyl]phenyl]methanol (PubChem CID 103581420) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is [4-[[(2,3-dimethyloxolan-3-yl)amino]methyl]phenyl]methanol.

Molecular Properties

Compound Name[4-[[(2,3-dimethyloxolan-3-yl)amino]methyl]phenyl]methanol
PubChem CID103581420
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name[4-[[(2,3-dimethyloxolan-3-yl)amino]methyl]phenyl]methanol
SMILESCC1OCCC1(C)NCc1ccc(CO)cc1
InChIInChI=1S/C14H21NO2/c1-11-14(2,7-8-17-11)15-9-12-3-5-13(10-16)6-4-12/h3-6,11,15-16H,7-10H2,1-2H3
InChIKeyGSLFEWWSEXTDIO-UHFFFAOYSA-N
XLogP1.84
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[(2,3-dimethyloxolan-3-yl)amino]methyl]-6-methylpyridin-3-ol
CID 113415143
(2S,3R,4S)-4-[[4-(4-chlorophenyl)phenyl]methylamino]-2,4-dimethyloxan-3-ol
CID 70889092
N-ethyl-2,3-dimethyloxolan-3-amine
CID 103581198
N-[(2-chloro-5-fluorophenyl)methyl]-2,3-dimethyloxolan-3-amine
CID 103581294
N-[(6-methoxy-2-pyridinyl)methyl]-2,3-dimethyloxolan-3-amine
CID 103527662
1-[(4-chlorophenyl)methoxy]-3-[(2,3-dimethyloxolan-3-yl)amino]propan-2-ol
CID 103581402
5-[[(2,3-dimethyloxolan-3-yl)amino]methyl]-2-methyl-1H-pyrrole-3-carboxylic acid
CID 114273627
N-(cyclopent-3-en-1-ylmethyl)-2,3-dimethyloxolan-3-amine
CID 164651458
1-[(2,3-dimethyloxolan-3-yl)amino]-3-phenylmethoxypropan-2-ol
CID 103581260
N-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethyl)-2,3-dimethyloxolan-3-amine
CID 114095834
2,3-dimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]oxolan-3-amine
CID 103581242
N-[[5-bromo-2-(difluoromethoxy)phenyl]methyl]-2,3-dimethyloxolan-3-amine
CID 103581455

Frequently Asked Questions

What is the IUPAC name of [4-[[(2,3-dimethyloxolan-3-yl)amino]methyl]phenyl]methanol?
The IUPAC name of [4-[[(2,3-dimethyloxolan-3-yl)amino]methyl]phenyl]methanol (CID 103581420) is [4-[[(2,3-dimethyloxolan-3-yl)amino]methyl]phenyl]methanol.
What is the SMILES notation for [4-[[(2,3-dimethyloxolan-3-yl)amino]methyl]phenyl]methanol?
The canonical SMILES for [4-[[(2,3-dimethyloxolan-3-yl)amino]methyl]phenyl]methanol is CC1OCCC1(C)NCc1ccc(CO)cc1.
What is the InChIKey of [4-[[(2,3-dimethyloxolan-3-yl)amino]methyl]phenyl]methanol?
The InChIKey is GSLFEWWSEXTDIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-11-14(2,7-8-17-11)15-9-12-3-5-13(10-16)6-4-12/h3-6,11,15-16H,7-10H2,1-2H3.
What are the key properties of [4-[[(2,3-dimethyloxolan-3-yl)amino]methyl]phenyl]methanol?
[4-[[(2,3-dimethyloxolan-3-yl)amino]methyl]phenyl]methanol has a molecular weight of 235.33 g/mol, XLogP of 1.84, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[(2,3-dimethyloxolan-3-yl)amino]methyl]phenyl]methanol is sourced from PubChem (CID 103581420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).