[2-[[3-(2-chlorophenyl)cyclobutyl]amino]cyclohexyl]methanol

C17H24ClNO — CID 106359773

IUPAC[2-[[3-(2-chlorophenyl)cyclobutyl]amino]cyclohexyl]methanol
SMILESOCC1CCCCC1NC1CC(c2ccccc2Cl)C1
InChIInChI=1S/C17H24ClNO/c18-16-7-3-2-6-15(16)13-9-14(10-13)19-17-8-4-1-5-12(17)11-20/h2-3,6-7,12-14,17,19-20H,1,4-5,8-11H2
InChIKeyGXDUVUBCYYPMFF-UHFFFAOYSA-N
MW293.84 g/mol
LogP3.73
Rot. Bonds4

About [2-[[3-(2-chlorophenyl)cyclobutyl]amino]cyclohexyl]methanol

[2-[[3-(2-chlorophenyl)cyclobutyl]amino]cyclohexyl]methanol (PubChem CID 106359773) has the molecular formula C17H24ClNO and a molecular weight of 293.84 g/mol. Its IUPAC name is [2-[[3-(2-chlorophenyl)cyclobutyl]amino]cyclohexyl]methanol.

Molecular Properties

Compound Name[2-[[3-(2-chlorophenyl)cyclobutyl]amino]cyclohexyl]methanol
PubChem CID106359773
Molecular FormulaC17H24ClNO
Molecular Weight293.84 g/mol
Exact Mass293.15
IUPAC Name[2-[[3-(2-chlorophenyl)cyclobutyl]amino]cyclohexyl]methanol
SMILESOCC1CCCCC1NC1CC(c2ccccc2Cl)C1
InChIInChI=1S/C17H24ClNO/c18-16-7-3-2-6-15(16)13-9-14(10-13)19-17-8-4-1-5-12(17)11-20/h2-3,6-7,12-14,17,19-20H,1,4-5,8-11H2
InChIKeyGXDUVUBCYYPMFF-UHFFFAOYSA-N
XLogP3.73
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.84
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-(2-chlorophenyl)cyclobutyl]thian-4-amine
CID 115646636
[2-[(3-methylcyclobutyl)amino]cyclohexyl]methanol
CID 104859822
[2-(3,4-dihydro-2H-thiochromen-4-ylamino)cyclopentyl]methanol
CID 113262116
1-(2-chlorophenyl)-2-[[2-(hydroxymethyl)cyclopentyl]amino]ethanol
CID 106360636
[2-(cyclopropylamino)cyclopentyl]methanol
CID 83863384
[2-[(3-methylcyclobutyl)amino]cyclopentyl]methanol
CID 104859835
[2-[(3-aminocyclobutyl)amino]cyclopentyl]methanol
CID 106359486
[2-[(3-methoxycyclobutyl)amino]cyclohexyl]methanol
CID 104871558
[2-[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]cyclohexyl]methanol
CID 103785054
3-[[3-(2-chlorophenyl)cyclobutyl]amino]-2,2-difluoropropan-1-ol
CID 106172971
4-[[3-(2-chlorophenyl)cyclobutyl]carbamoylamino]cyclohexane-1-carboxylic acid
CID 122015655
2-[[3-(2-chlorophenyl)cyclobutyl]amino]butan-1-ol
CID 43634747

Frequently Asked Questions

What is the IUPAC name of [2-[[3-(2-chlorophenyl)cyclobutyl]amino]cyclohexyl]methanol?
The IUPAC name of [2-[[3-(2-chlorophenyl)cyclobutyl]amino]cyclohexyl]methanol (CID 106359773) is [2-[[3-(2-chlorophenyl)cyclobutyl]amino]cyclohexyl]methanol.
What is the SMILES notation for [2-[[3-(2-chlorophenyl)cyclobutyl]amino]cyclohexyl]methanol?
The canonical SMILES for [2-[[3-(2-chlorophenyl)cyclobutyl]amino]cyclohexyl]methanol is OCC1CCCCC1NC1CC(c2ccccc2Cl)C1.
What is the InChIKey of [2-[[3-(2-chlorophenyl)cyclobutyl]amino]cyclohexyl]methanol?
The InChIKey is GXDUVUBCYYPMFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24ClNO/c18-16-7-3-2-6-15(16)13-9-14(10-13)19-17-8-4-1-5-12(17)11-20/h2-3,6-7,12-14,17,19-20H,1,4-5,8-11H2.
What are the key properties of [2-[[3-(2-chlorophenyl)cyclobutyl]amino]cyclohexyl]methanol?
[2-[[3-(2-chlorophenyl)cyclobutyl]amino]cyclohexyl]methanol has a molecular weight of 293.84 g/mol, XLogP of 3.73, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[3-(2-chlorophenyl)cyclobutyl]amino]cyclohexyl]methanol is sourced from PubChem (CID 106359773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).