1-[[[3-(3-methoxyphenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol

C17H25NO2 — CID 65105160

IUPAC1-[[[3-(3-methoxyphenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol
SMILESCOc1cccc(C2CC(NCC3(O)CCCC3)C2)c1
InChIInChI=1S/C17H25NO2/c1-20-16-6-4-5-13(11-16)14-9-15(10-14)18-12-17(19)7-2-3-8-17/h4-6,11,14-15,18-19H,2-3,7-10,12H2,1H3
InChIKeyQYXKGRIBUGQNRL-UHFFFAOYSA-N
MW275.39 g/mol
LogP2.84
Rot. Bonds5

About 1-[[[3-(3-methoxyphenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol

1-[[[3-(3-methoxyphenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol (PubChem CID 65105160) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is 1-[[[3-(3-methoxyphenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[[3-(3-methoxyphenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol
PubChem CID65105160
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC Name1-[[[3-(3-methoxyphenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol
SMILESCOc1cccc(C2CC(NCC3(O)CCCC3)C2)c1
InChIInChI=1S/C17H25NO2/c1-20-16-6-4-5-13(11-16)14-9-15(10-14)18-12-17(19)7-2-3-8-17/h4-6,11,14-15,18-19H,2-3,7-10,12H2,1H3
InChIKeyQYXKGRIBUGQNRL-UHFFFAOYSA-N
XLogP2.84
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[[[3-(3-methoxyphenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol with MolForge

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Related Compounds

2-[1-[[[3-(3-methoxyphenyl)cyclobutyl]amino]methyl]cyclopropyl]ethanol
CID 114756110
N-[(3-methoxyoxolan-3-yl)methyl]-3-(3-methoxyphenyl)cyclobutan-1-amine
CID 104759729
3-[[[3-(3-methoxyphenyl)cyclobutyl]amino]methyl]pentan-3-ol
CID 65107986
N-[(1-hydroxycycloheptyl)methyl]-2-(3-methoxyphenyl)cyclopropane-1-carboxamide
CID 111433093
N-(2,3-dimethylbutyl)-3-(3-methoxyphenyl)cyclobutan-1-amine
CID 64569258
N-(2,2-dimethylbutyl)-3-(3-methoxyphenyl)cyclobutan-1-amine
CID 103699490
3-(3-methoxyphenyl)-N-(2-methylsulfanylethyl)cyclobutan-1-amine
CID 63981363
N'-cyclopropyl-N-[3-(3-methoxyphenyl)cyclobutyl]-N'-methylethane-1,2-diamine
CID 62975535
1-[[[3-(4-chlorophenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol
CID 65107309
3-(3-methoxyphenyl)-N-[(6-methyl-3-pyridinyl)methyl]cyclobutan-1-amine
CID 62997574
1-[[[3-(3-bromophenyl)cyclobutyl]amino]methyl]-3-methylcyclohexan-1-ol
CID 65117005
1-[[[3-(3-chlorophenyl)cyclobutyl]amino]methyl]-3-methylcyclohexan-1-ol
CID 65117012

Frequently Asked Questions

What is the IUPAC name of 1-[[[3-(3-methoxyphenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[[3-(3-methoxyphenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol (CID 65105160) is 1-[[[3-(3-methoxyphenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[[3-(3-methoxyphenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[[3-(3-methoxyphenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol is COc1cccc(C2CC(NCC3(O)CCCC3)C2)c1.
What is the InChIKey of 1-[[[3-(3-methoxyphenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol?
The InChIKey is QYXKGRIBUGQNRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO2/c1-20-16-6-4-5-13(11-16)14-9-15(10-14)18-12-17(19)7-2-3-8-17/h4-6,11,14-15,18-19H,2-3,7-10,12H2,1H3.
What are the key properties of 1-[[[3-(3-methoxyphenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol?
1-[[[3-(3-methoxyphenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol has a molecular weight of 275.39 g/mol, XLogP of 2.84, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[[3-(3-methoxyphenyl)cyclobutyl]amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 65105160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).