2-[[1-methoxypropan-2-yl(methyl)amino]methyl]cyclopentan-1-one

C11H21NO2 — CID 62612218

IUPAC2-[[1-methoxypropan-2-yl(methyl)amino]methyl]cyclopentan-1-one
SMILESCOCC(C)N(C)CC1CCCC1=O
InChIInChI=1S/C11H21NO2/c1-9(8-14-3)12(2)7-10-5-4-6-11(10)13/h9-10H,4-8H2,1-3H3
InChIKeyMGHUEUCZSPEVQK-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.32
Rot. Bonds5

About 2-[[1-methoxypropan-2-yl(methyl)amino]methyl]cyclopentan-1-one

2-[[1-methoxypropan-2-yl(methyl)amino]methyl]cyclopentan-1-one (PubChem CID 62612218) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 2-[[1-methoxypropan-2-yl(methyl)amino]methyl]cyclopentan-1-one.

Molecular Properties

Compound Name2-[[1-methoxypropan-2-yl(methyl)amino]methyl]cyclopentan-1-one
PubChem CID62612218
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name2-[[1-methoxypropan-2-yl(methyl)amino]methyl]cyclopentan-1-one
SMILESCOCC(C)N(C)CC1CCCC1=O
InChIInChI=1S/C11H21NO2/c1-9(8-14-3)12(2)7-10-5-4-6-11(10)13/h9-10H,4-8H2,1-3H3
InChIKeyMGHUEUCZSPEVQK-UHFFFAOYSA-N
XLogP1.32
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 2057148
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CID 5200367
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CID 6358657
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CID 7107068
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CID 7107070
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CID 7201365
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Frequently Asked Questions

What is the IUPAC name of 2-[[1-methoxypropan-2-yl(methyl)amino]methyl]cyclopentan-1-one?
The IUPAC name of 2-[[1-methoxypropan-2-yl(methyl)amino]methyl]cyclopentan-1-one (CID 62612218) is 2-[[1-methoxypropan-2-yl(methyl)amino]methyl]cyclopentan-1-one.
What is the SMILES notation for 2-[[1-methoxypropan-2-yl(methyl)amino]methyl]cyclopentan-1-one?
The canonical SMILES for 2-[[1-methoxypropan-2-yl(methyl)amino]methyl]cyclopentan-1-one is COCC(C)N(C)CC1CCCC1=O.
What is the InChIKey of 2-[[1-methoxypropan-2-yl(methyl)amino]methyl]cyclopentan-1-one?
The InChIKey is MGHUEUCZSPEVQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-9(8-14-3)12(2)7-10-5-4-6-11(10)13/h9-10H,4-8H2,1-3H3.
What are the key properties of 2-[[1-methoxypropan-2-yl(methyl)amino]methyl]cyclopentan-1-one?
2-[[1-methoxypropan-2-yl(methyl)amino]methyl]cyclopentan-1-one has a molecular weight of 199.29 g/mol, XLogP of 1.32, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-methoxypropan-2-yl(methyl)amino]methyl]cyclopentan-1-one is sourced from PubChem (CID 62612218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).