[1-(methylamino)-2-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]cyclopentyl]methanol

C15H30N2O2 — CID 79571001

IUPAC[1-(methylamino)-2-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]cyclopentyl]methanol
SMILESCNC1(CO)CCCC1CCN1CCCOC(C)C1
InChIInChI=1S/C15H30N2O2/c1-13-11-17(8-4-10-19-13)9-6-14-5-3-7-15(14,12-18)16-2/h13-14,16,18H,3-12H2,1-2H3
InChIKeyVKSYLMHJKUGKAS-UHFFFAOYSA-N
MW270.42 g/mol
LogP1.24
Rot. Bonds5

About [1-(methylamino)-2-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]cyclopentyl]methanol

[1-(methylamino)-2-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]cyclopentyl]methanol (PubChem CID 79571001) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is [1-(methylamino)-2-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(methylamino)-2-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]cyclopentyl]methanol
PubChem CID79571001
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name[1-(methylamino)-2-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]cyclopentyl]methanol
SMILESCNC1(CO)CCCC1CCN1CCCOC(C)C1
InChIInChI=1S/C15H30N2O2/c1-13-11-17(8-4-10-19-13)9-6-14-5-3-7-15(14,12-18)16-2/h13-14,16,18H,3-12H2,1-2H3
InChIKeyVKSYLMHJKUGKAS-UHFFFAOYSA-N
XLogP1.24
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[1-amino-2-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]cyclopentyl]methanol
CID 79571069
[2-[2-[3-(dimethylamino)pyrrolidin-1-yl]ethyl]-1-(methylamino)cyclopentyl]methanol
CID 79571423
[2-[2-(3,5-dimethylpiperidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol
CID 79571011
[2-[2-(5-ethyl-2-methylmorpholin-4-yl)ethyl]-1-(methylamino)cyclopentyl]methanol
CID 79571316
1-(ethylamino)-2-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]cyclopentane-1-carboxylic acid
CID 79572796
[2-[2-[4-(dimethylamino)piperidin-1-yl]ethyl]-1-(methylamino)cyclopentyl]methanol
CID 79571164
[2-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79567766
[2-[2-(3,4-dimethoxypyrrolidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol
CID 103540797
[2-[2-(4,4-diethylpiperidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol
CID 79573438
[2-[2-(1,1-dioxo-1,4-thiazinan-4-yl)ethyl]-1-(methylamino)cyclopentyl]methanol
CID 79570958
[2-[2-(4-tert-butylpiperidin-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol
CID 79572951
[2-[2-(3-methylpyrrolidin-1-yl)ethyl]-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79571310

Frequently Asked Questions

What is the IUPAC name of [1-(methylamino)-2-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]cyclopentyl]methanol?
The IUPAC name of [1-(methylamino)-2-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]cyclopentyl]methanol (CID 79571001) is [1-(methylamino)-2-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]cyclopentyl]methanol.
What is the SMILES notation for [1-(methylamino)-2-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]cyclopentyl]methanol?
The canonical SMILES for [1-(methylamino)-2-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]cyclopentyl]methanol is CNC1(CO)CCCC1CCN1CCCOC(C)C1.
What is the InChIKey of [1-(methylamino)-2-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]cyclopentyl]methanol?
The InChIKey is VKSYLMHJKUGKAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-13-11-17(8-4-10-19-13)9-6-14-5-3-7-15(14,12-18)16-2/h13-14,16,18H,3-12H2,1-2H3.
What are the key properties of [1-(methylamino)-2-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]cyclopentyl]methanol?
[1-(methylamino)-2-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]cyclopentyl]methanol has a molecular weight of 270.42 g/mol, XLogP of 1.24, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(methylamino)-2-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]cyclopentyl]methanol is sourced from PubChem (CID 79571001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).