[1-[(2,5-dimethylphenyl)-(methylamino)methyl]cyclopropyl]methanol

C14H21NO — CID 116958233

IUPAC[1-[(2,5-dimethylphenyl)-(methylamino)methyl]cyclopropyl]methanol
SMILESCNC(c1cc(C)ccc1C)C1(CO)CC1
InChIInChI=1S/C14H21NO/c1-10-4-5-11(2)12(8-10)13(15-3)14(9-16)6-7-14/h4-5,8,13,15-16H,6-7,9H2,1-3H3
InChIKeyUYZXPUOVOBTEDO-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.34
Rot. Bonds4

About [1-[(2,5-dimethylphenyl)-(methylamino)methyl]cyclopropyl]methanol

[1-[(2,5-dimethylphenyl)-(methylamino)methyl]cyclopropyl]methanol (PubChem CID 116958233) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is [1-[(2,5-dimethylphenyl)-(methylamino)methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[(2,5-dimethylphenyl)-(methylamino)methyl]cyclopropyl]methanol
PubChem CID116958233
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name[1-[(2,5-dimethylphenyl)-(methylamino)methyl]cyclopropyl]methanol
SMILESCNC(c1cc(C)ccc1C)C1(CO)CC1
InChIInChI=1S/C14H21NO/c1-10-4-5-11(2)12(8-10)13(15-3)14(9-16)6-7-14/h4-5,8,13,15-16H,6-7,9H2,1-3H3
InChIKeyUYZXPUOVOBTEDO-UHFFFAOYSA-N
XLogP2.34
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[1-[(2-methoxy-5-methylphenyl)-(methylamino)methyl]cyclopropyl]methanol
CID 116958241
1-[(2,5-dimethylphenyl)-(methylamino)methyl]cyclobutane-1-carboxylic acid
CID 116958928
[1-[methylamino-(2,3,4-trimethylphenyl)methyl]cyclobutyl]methanol
CID 116959084
1-[(2,5-dimethylphenyl)-(methylamino)methyl]-N,N-dimethylcyclopentan-1-amine
CID 79070605
(2S)-2-(2,5-dimethylphenyl)-2-(methylamino)ethanol
CID 55276234
[1-[(4-methoxy-2,3-dimethylphenyl)-(methylamino)methyl]cyclopropyl]methanol
CID 116958294
1-[1-(aminomethyl)cyclobutyl]-1-(2,4-dimethylphenyl)-N-methylmethanamine
CID 116958764
3-(2,5-dimethylphenyl)-3-(methylamino)propan-1-ol
CID 64812187
1-(2,5-dimethylphenyl)-N-methylpropan-1-amine
CID 43483756
[1-[(3-bromophenyl)-(methylamino)methyl]cyclopropyl]methanol
CID 116958336
[1-[(2-methoxyphenyl)-(methylamino)methyl]cyclobutyl]methanol
CID 116959077
[3-[(3,4-dimethylphenyl)-(methylamino)methyl]oxetan-3-yl]methanol
CID 116959451

Frequently Asked Questions

What is the IUPAC name of [1-[(2,5-dimethylphenyl)-(methylamino)methyl]cyclopropyl]methanol?
The IUPAC name of [1-[(2,5-dimethylphenyl)-(methylamino)methyl]cyclopropyl]methanol (CID 116958233) is [1-[(2,5-dimethylphenyl)-(methylamino)methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[(2,5-dimethylphenyl)-(methylamino)methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[(2,5-dimethylphenyl)-(methylamino)methyl]cyclopropyl]methanol is CNC(c1cc(C)ccc1C)C1(CO)CC1.
What is the InChIKey of [1-[(2,5-dimethylphenyl)-(methylamino)methyl]cyclopropyl]methanol?
The InChIKey is UYZXPUOVOBTEDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-10-4-5-11(2)12(8-10)13(15-3)14(9-16)6-7-14/h4-5,8,13,15-16H,6-7,9H2,1-3H3.
What are the key properties of [1-[(2,5-dimethylphenyl)-(methylamino)methyl]cyclopropyl]methanol?
[1-[(2,5-dimethylphenyl)-(methylamino)methyl]cyclopropyl]methanol has a molecular weight of 219.33 g/mol, XLogP of 2.34, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(2,5-dimethylphenyl)-(methylamino)methyl]cyclopropyl]methanol is sourced from PubChem (CID 116958233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).