10-[butan-2-yl(ethyl)amino]spiro[4.5]decan-8-ol

C16H31NO — CID 164663732

IUPAC10-[butan-2-yl(ethyl)amino]spiro[4.5]decan-8-ol
SMILESCCC(C)N(CC)C1CC(O)CCC12CCCC2
InChIInChI=1S/C16H31NO/c1-4-13(3)17(5-2)15-12-14(18)8-11-16(15)9-6-7-10-16/h13-15,18H,4-12H2,1-3H3
InChIKeyVJJPLIAQNQZFQV-UHFFFAOYSA-N
MW253.43 g/mol
LogP3.58
Rot. Bonds4

About 10-[butan-2-yl(ethyl)amino]spiro[4.5]decan-8-ol

10-[butan-2-yl(ethyl)amino]spiro[4.5]decan-8-ol (PubChem CID 164663732) has the molecular formula C16H31NO and a molecular weight of 253.43 g/mol. Its IUPAC name is 10-[butan-2-yl(ethyl)amino]spiro[4.5]decan-8-ol.

Molecular Properties

Compound Name10-[butan-2-yl(ethyl)amino]spiro[4.5]decan-8-ol
PubChem CID164663732
Molecular FormulaC16H31NO
Molecular Weight253.43 g/mol
Exact Mass253.24
IUPAC Name10-[butan-2-yl(ethyl)amino]spiro[4.5]decan-8-ol
SMILESCCC(C)N(CC)C1CC(O)CCC12CCCC2
InChIInChI=1S/C16H31NO/c1-4-13(3)17(5-2)15-12-14(18)8-11-16(15)9-6-7-10-16/h13-15,18H,4-12H2,1-3H3
InChIKeyVJJPLIAQNQZFQV-UHFFFAOYSA-N
XLogP3.58
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
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-(Difluoromethyl)pyrrolidin-1-yl]spiro[4.5]decan-8-ol
CID 165491363
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-(4-Fluoropiperidin-1-yl)-4,4-dimethylcyclohexan-1-ol
CID 165491489
3-[Methyl(2,2,2-trifluoroethyl)amino]-4-(2-methylbutan-2-yl)cyclohexan-1-ol
CID 165491558
3-[(2,2-Difluoroethyl)(propyl)amino]-4-(2-methylbutan-2-yl)cyclohexan-1-ol
CID 165491566
3-(4-Fluoropiperidin-1-yl)-4-(2-methylbutan-2-yl)cyclohexan-1-ol
CID 165491569
3-[(2,2-Difluoropropyl)(methyl)amino]-4-(2-methylbutan-2-yl)cyclohexan-1-ol
CID 165491570

Frequently Asked Questions

What is the IUPAC name of 10-[butan-2-yl(ethyl)amino]spiro[4.5]decan-8-ol?
The IUPAC name of 10-[butan-2-yl(ethyl)amino]spiro[4.5]decan-8-ol (CID 164663732) is 10-[butan-2-yl(ethyl)amino]spiro[4.5]decan-8-ol.
What is the SMILES notation for 10-[butan-2-yl(ethyl)amino]spiro[4.5]decan-8-ol?
The canonical SMILES for 10-[butan-2-yl(ethyl)amino]spiro[4.5]decan-8-ol is CCC(C)N(CC)C1CC(O)CCC12CCCC2.
What is the InChIKey of 10-[butan-2-yl(ethyl)amino]spiro[4.5]decan-8-ol?
The InChIKey is VJJPLIAQNQZFQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31NO/c1-4-13(3)17(5-2)15-12-14(18)8-11-16(15)9-6-7-10-16/h13-15,18H,4-12H2,1-3H3.
What are the key properties of 10-[butan-2-yl(ethyl)amino]spiro[4.5]decan-8-ol?
10-[butan-2-yl(ethyl)amino]spiro[4.5]decan-8-ol has a molecular weight of 253.43 g/mol, XLogP of 3.58, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[butan-2-yl(ethyl)amino]spiro[4.5]decan-8-ol is sourced from PubChem (CID 164663732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).