10-[methyl(2-methylbutan-2-yl)amino]spiro[4.5]decan-8-ol

C16H31NO — CID 165490960

IUPAC10-[methyl(2-methylbutan-2-yl)amino]spiro[4.5]decan-8-ol
SMILESCCC(C)(C)N(C)C1CC(O)CCC12CCCC2
InChIInChI=1S/C16H31NO/c1-5-15(2,3)17(4)14-12-13(18)8-11-16(14)9-6-7-10-16/h13-14,18H,5-12H2,1-4H3
InChIKeyDEEYRAHVWJSUEG-UHFFFAOYSA-N
MW253.43 g/mol
LogP3.58
Rot. Bonds3

About 10-[methyl(2-methylbutan-2-yl)amino]spiro[4.5]decan-8-ol

10-[methyl(2-methylbutan-2-yl)amino]spiro[4.5]decan-8-ol (PubChem CID 165490960) has the molecular formula C16H31NO and a molecular weight of 253.43 g/mol. Its IUPAC name is 10-[methyl(2-methylbutan-2-yl)amino]spiro[4.5]decan-8-ol.

Molecular Properties

Compound Name10-[methyl(2-methylbutan-2-yl)amino]spiro[4.5]decan-8-ol
PubChem CID165490960
Molecular FormulaC16H31NO
Molecular Weight253.43 g/mol
Exact Mass253.24
IUPAC Name10-[methyl(2-methylbutan-2-yl)amino]spiro[4.5]decan-8-ol
SMILESCCC(C)(C)N(C)C1CC(O)CCC12CCCC2
InChIInChI=1S/C16H31NO/c1-5-15(2,3)17(4)14-12-13(18)8-11-16(14)9-6-7-10-16/h13-14,18H,5-12H2,1-4H3
InChIKeyDEEYRAHVWJSUEG-UHFFFAOYSA-N
XLogP3.58
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-[(2,2-Difluoroethyl)(ethyl)amino]spiro[4.5]decan-8-ol
CID 165490978
6-[3-(Fluoromethyl)pyrrolidin-1-yl]spiro[4.5]decan-8-ol
CID 165490982
6-(3,3-Difluoropiperidin-1-yl)spiro[4.5]decan-8-ol
CID 165490983
6-(3-Fluoropiperidin-1-yl)spiro[4.5]decan-8-ol
CID 165490984
6-[(3-Fluoropropyl)(methyl)amino]spiro[4.5]decan-8-ol
CID 165491365
3-[(2,2-Difluoroethyl)(ethyl)amino]-4,4-dimethylcyclohexan-1-ol
CID 165491484
3-[(2,2-Difluoroethyl)(propyl)amino]-4-(2-methylbutan-2-yl)cyclohexan-1-ol
CID 165491566
4,4-Dimethyl-3-[methyl(3,3,3-trifluoropropyl)amino]cyclohexan-1-ol
CID 165496359
6-(3,3-Difluoropyrrolidin-1-yl)spiro[4.5]decan-8-ol
CID 165496828
6-[3-(Fluoromethyl)piperidin-1-yl]spiro[4.5]decan-8-ol
CID 165496836
6-(4,4-Difluoropiperidin-1-yl)spiro[4.5]decan-8-ol
CID 165496838
6-[(2-Fluoroethyl)(2-methoxyethyl)amino]spiro[4.5]decan-8-ol
CID 165496840

Frequently Asked Questions

What is the IUPAC name of 10-[methyl(2-methylbutan-2-yl)amino]spiro[4.5]decan-8-ol?
The IUPAC name of 10-[methyl(2-methylbutan-2-yl)amino]spiro[4.5]decan-8-ol (CID 165490960) is 10-[methyl(2-methylbutan-2-yl)amino]spiro[4.5]decan-8-ol.
What is the SMILES notation for 10-[methyl(2-methylbutan-2-yl)amino]spiro[4.5]decan-8-ol?
The canonical SMILES for 10-[methyl(2-methylbutan-2-yl)amino]spiro[4.5]decan-8-ol is CCC(C)(C)N(C)C1CC(O)CCC12CCCC2.
What is the InChIKey of 10-[methyl(2-methylbutan-2-yl)amino]spiro[4.5]decan-8-ol?
The InChIKey is DEEYRAHVWJSUEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31NO/c1-5-15(2,3)17(4)14-12-13(18)8-11-16(14)9-6-7-10-16/h13-14,18H,5-12H2,1-4H3.
What are the key properties of 10-[methyl(2-methylbutan-2-yl)amino]spiro[4.5]decan-8-ol?
10-[methyl(2-methylbutan-2-yl)amino]spiro[4.5]decan-8-ol has a molecular weight of 253.43 g/mol, XLogP of 3.58, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[methyl(2-methylbutan-2-yl)amino]spiro[4.5]decan-8-ol is sourced from PubChem (CID 165490960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).