[1-[(2-cyclopropylphenyl)methylamino]cyclobutyl]methanol

C15H21NO — CID 113263667

IUPAC[1-[(2-cyclopropylphenyl)methylamino]cyclobutyl]methanol
SMILESOCC1(NCc2ccccc2C2CC2)CCC1
InChIInChI=1S/C15H21NO/c17-11-15(8-3-9-15)16-10-13-4-1-2-5-14(13)12-6-7-12/h1-2,4-5,12,16-17H,3,6-11H2
InChIKeyOWBYPSGAXTYVPO-UHFFFAOYSA-N
MW231.34 g/mol
LogP2.57
Rot. Bonds5

About [1-[(2-cyclopropylphenyl)methylamino]cyclobutyl]methanol

[1-[(2-cyclopropylphenyl)methylamino]cyclobutyl]methanol (PubChem CID 113263667) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is [1-[(2-cyclopropylphenyl)methylamino]cyclobutyl]methanol.

Molecular Properties

Compound Name[1-[(2-cyclopropylphenyl)methylamino]cyclobutyl]methanol
PubChem CID113263667
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Name[1-[(2-cyclopropylphenyl)methylamino]cyclobutyl]methanol
SMILESOCC1(NCc2ccccc2C2CC2)CCC1
InChIInChI=1S/C15H21NO/c17-11-15(8-3-9-15)16-10-13-4-1-2-5-14(13)12-6-7-12/h1-2,4-5,12,16-17H,3,6-11H2
InChIKeyOWBYPSGAXTYVPO-UHFFFAOYSA-N
XLogP2.57
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[1-[(2-cyclopropylphenyl)methylamino]cyclohexyl]methanol
CID 79984076
[1-[(2-methylphenyl)methylamino]cyclobutyl]methanol
CID 115733245
[1-[(2-fluorophenyl)methylamino]cyclohexyl]methanol
CID 55082363
[1-[(2,3-dimethylphenyl)methylamino]cyclobutyl]methanol
CID 115733266
2-[(2-cyclopropylphenyl)methylamino]acetic acid
CID 79979274
1-(2-cyclopropylphenyl)-N-[(1-methylcyclopentyl)methyl]methanamine
CID 79984685
2-chloro-6-[[[1-(hydroxymethyl)cyclobutyl]amino]methyl]phenol
CID 115924196
[1-[(2-nitrophenyl)methylamino]cyclopentyl]methanol
CID 62524980
[2-[(2-cyclopropylphenyl)methylamino]phenyl]methanol
CID 79979361
[1-(1H-indol-7-ylmethylamino)cyclobutyl]methanol
CID 113263647
2-[1-[(2-methylphenyl)methylamino]cyclobutyl]ethanol;hydrochloride
CID 115673984
2-[1-[(2-chlorophenyl)methylamino]cyclobutyl]ethanol;hydrochloride
CID 115673948

Frequently Asked Questions

What is the IUPAC name of [1-[(2-cyclopropylphenyl)methylamino]cyclobutyl]methanol?
The IUPAC name of [1-[(2-cyclopropylphenyl)methylamino]cyclobutyl]methanol (CID 113263667) is [1-[(2-cyclopropylphenyl)methylamino]cyclobutyl]methanol.
What is the SMILES notation for [1-[(2-cyclopropylphenyl)methylamino]cyclobutyl]methanol?
The canonical SMILES for [1-[(2-cyclopropylphenyl)methylamino]cyclobutyl]methanol is OCC1(NCc2ccccc2C2CC2)CCC1.
What is the InChIKey of [1-[(2-cyclopropylphenyl)methylamino]cyclobutyl]methanol?
The InChIKey is OWBYPSGAXTYVPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c17-11-15(8-3-9-15)16-10-13-4-1-2-5-14(13)12-6-7-12/h1-2,4-5,12,16-17H,3,6-11H2.
What are the key properties of [1-[(2-cyclopropylphenyl)methylamino]cyclobutyl]methanol?
[1-[(2-cyclopropylphenyl)methylamino]cyclobutyl]methanol has a molecular weight of 231.34 g/mol, XLogP of 2.57, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(2-cyclopropylphenyl)methylamino]cyclobutyl]methanol is sourced from PubChem (CID 113263667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).