methyl 3-(8-azaspiro[4.5]decan-8-yl)-1-(methylamino)cyclopentane-1-carboxylate

C17H30N2O2 — CID 79644417

IUPACmethyl 3-(8-azaspiro[4.5]decan-8-yl)-1-(methylamino)cyclopentane-1-carboxylate
SMILESCNC1(C(=O)OC)CCC(N2CCC3(CCCC3)CC2)C1
InChIInChI=1S/C17H30N2O2/c1-18-17(15(20)21-2)8-5-14(13-17)19-11-9-16(10-12-19)6-3-4-7-16/h14,18H,3-13H2,1-2H3
InChIKeyZEVUDGZMSIQYNP-UHFFFAOYSA-N
MW294.44 g/mol
LogP2.33
Rot. Bonds3

About methyl 3-(8-azaspiro[4.5]decan-8-yl)-1-(methylamino)cyclopentane-1-carboxylate

methyl 3-(8-azaspiro[4.5]decan-8-yl)-1-(methylamino)cyclopentane-1-carboxylate (PubChem CID 79644417) has the molecular formula C17H30N2O2 and a molecular weight of 294.44 g/mol. Its IUPAC name is methyl 3-(8-azaspiro[4.5]decan-8-yl)-1-(methylamino)cyclopentane-1-carboxylate.

Molecular Properties

Compound Namemethyl 3-(8-azaspiro[4.5]decan-8-yl)-1-(methylamino)cyclopentane-1-carboxylate
PubChem CID79644417
Molecular FormulaC17H30N2O2
Molecular Weight294.44 g/mol
Exact Mass294.23
IUPAC Namemethyl 3-(8-azaspiro[4.5]decan-8-yl)-1-(methylamino)cyclopentane-1-carboxylate
SMILESCNC1(C(=O)OC)CCC(N2CCC3(CCCC3)CC2)C1
InChIInChI=1S/C17H30N2O2/c1-18-17(15(20)21-2)8-5-14(13-17)19-11-9-16(10-12-19)6-3-4-7-16/h14,18H,3-13H2,1-2H3
InChIKeyZEVUDGZMSIQYNP-UHFFFAOYSA-N
XLogP2.33
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze methyl 3-(8-azaspiro[4.5]decan-8-yl)-1-(methylamino)cyclopentane-1-carboxylate with MolForge

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Related Compounds

methyl 1-(methylamino)-3-(4-propan-2-ylpiperazin-1-yl)cyclopentane-1-carboxylate
CID 79655269
ethyl 1-(methylamino)-3-pyrrolidin-1-ylcyclopentane-1-carboxylate
CID 79649541
methyl 3-(2-ethylpiperidin-1-yl)-1-(methylamino)cyclopentane-1-carboxylate
CID 79654810
3-(4-cyclopropylpiperazin-1-yl)-1-(methylamino)cyclopentane-1-carboxylic acid
CID 79651754
methyl 3-(2,2-dimethylmorpholin-4-yl)-1-(methylamino)cyclohexane-1-carboxylate
CID 79641601
3-(4-cyclopropylpiperazin-1-yl)-1-(methylamino)cyclopentane-1-carboxamide
CID 79651474
methyl 1-(cyclopropylamino)-3-(4-methoxypiperidin-1-yl)cyclopentane-1-carboxylate
CID 79645623
ethyl 1-(methylamino)-3-(4-propylpiperazin-1-yl)cyclopentane-1-carboxylate
CID 79645136
methyl 1-(ethylamino)-3-(4-propan-2-ylpiperidin-1-yl)cyclopentane-1-carboxylate
CID 103502038
methyl 3-(2-ethylpiperidin-1-yl)-1-(methylamino)cyclohexane-1-carboxylate
CID 79636980
1-amino-3-(3-azaspiro[5.5]undecan-3-yl)cyclopentane-1-carboxylic acid
CID 79650981
methyl 1-(cyclopropylamino)-3-(3,3-dimethylpiperidin-1-yl)cyclopentane-1-carboxylate
CID 79645176

Frequently Asked Questions

What is the IUPAC name of methyl 3-(8-azaspiro[4.5]decan-8-yl)-1-(methylamino)cyclopentane-1-carboxylate?
The IUPAC name of methyl 3-(8-azaspiro[4.5]decan-8-yl)-1-(methylamino)cyclopentane-1-carboxylate (CID 79644417) is methyl 3-(8-azaspiro[4.5]decan-8-yl)-1-(methylamino)cyclopentane-1-carboxylate.
What is the SMILES notation for methyl 3-(8-azaspiro[4.5]decan-8-yl)-1-(methylamino)cyclopentane-1-carboxylate?
The canonical SMILES for methyl 3-(8-azaspiro[4.5]decan-8-yl)-1-(methylamino)cyclopentane-1-carboxylate is CNC1(C(=O)OC)CCC(N2CCC3(CCCC3)CC2)C1.
What is the InChIKey of methyl 3-(8-azaspiro[4.5]decan-8-yl)-1-(methylamino)cyclopentane-1-carboxylate?
The InChIKey is ZEVUDGZMSIQYNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O2/c1-18-17(15(20)21-2)8-5-14(13-17)19-11-9-16(10-12-19)6-3-4-7-16/h14,18H,3-13H2,1-2H3.
What are the key properties of methyl 3-(8-azaspiro[4.5]decan-8-yl)-1-(methylamino)cyclopentane-1-carboxylate?
methyl 3-(8-azaspiro[4.5]decan-8-yl)-1-(methylamino)cyclopentane-1-carboxylate has a molecular weight of 294.44 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 3-(8-azaspiro[4.5]decan-8-yl)-1-(methylamino)cyclopentane-1-carboxylate is sourced from PubChem (CID 79644417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).