3-(8-azaspiro[4.5]decan-8-yl)-2-methyl-N-propan-2-ylbutan-1-amine

C17H34N2 — CID 79409918

IUPAC3-(8-azaspiro[4.5]decan-8-yl)-2-methyl-N-propan-2-ylbutan-1-amine
SMILESCC(C)NCC(C)C(C)N1CCC2(CCCC2)CC1
InChIInChI=1S/C17H34N2/c1-14(2)18-13-15(3)16(4)19-11-9-17(10-12-19)7-5-6-8-17/h14-16,18H,5-13H2,1-4H3
InChIKeyALSIEKJQJWAVQL-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.67
Rot. Bonds5

About 3-(8-azaspiro[4.5]decan-8-yl)-2-methyl-N-propan-2-ylbutan-1-amine

3-(8-azaspiro[4.5]decan-8-yl)-2-methyl-N-propan-2-ylbutan-1-amine (PubChem CID 79409918) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 3-(8-azaspiro[4.5]decan-8-yl)-2-methyl-N-propan-2-ylbutan-1-amine.

Molecular Properties

Compound Name3-(8-azaspiro[4.5]decan-8-yl)-2-methyl-N-propan-2-ylbutan-1-amine
PubChem CID79409918
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name3-(8-azaspiro[4.5]decan-8-yl)-2-methyl-N-propan-2-ylbutan-1-amine
SMILESCC(C)NCC(C)C(C)N1CCC2(CCCC2)CC1
InChIInChI=1S/C17H34N2/c1-14(2)18-13-15(3)16(4)19-11-9-17(10-12-19)7-5-6-8-17/h14-16,18H,5-13H2,1-4H3
InChIKeyALSIEKJQJWAVQL-UHFFFAOYSA-N
XLogP3.67
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(8-azaspiro[4.5]decan-8-yl)-N,2-dimethylbutan-1-amine
CID 79409713
2-(8-azaspiro[4.5]decan-8-yl)-3-methyl-N-propan-2-ylbutan-1-amine
CID 63163539
3-(3,3-dimethylpiperidin-1-yl)-2-methyl-N-propan-2-ylbutan-1-amine
CID 79408655
3-(8-azaspiro[4.5]decan-8-yl)butan-2-ol
CID 63158941
2-(8-azaspiro[4.5]decan-8-yl)-N-methylpropan-1-amine
CID 63163571
N,N-dimethyl-1-[3-methyl-4-(propan-2-ylamino)butan-2-yl]piperidin-4-amine
CID 79409671
2-(8-azaspiro[4.5]decan-8-yl)-N-prop-2-ynylpropan-1-amine
CID 63163175
3-(2,2-dimethylmorpholin-4-yl)-2-methyl-N-propan-2-ylbutan-1-amine
CID 79408711
2-(8-azaspiro[4.5]decan-8-yl)-3-methylbutan-1-amine
CID 63157149
methyl 3-(3-azaspiro[5.5]undecan-3-yl)-2-methylbutanoate
CID 79414044
3-(3-methylpentan-2-yl)-3,9-diazaspiro[5.5]undecane
CID 112751094
2-methyl-3-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)-N-propan-2-ylbutan-1-amine
CID 114413363

Frequently Asked Questions

What is the IUPAC name of 3-(8-azaspiro[4.5]decan-8-yl)-2-methyl-N-propan-2-ylbutan-1-amine?
The IUPAC name of 3-(8-azaspiro[4.5]decan-8-yl)-2-methyl-N-propan-2-ylbutan-1-amine (CID 79409918) is 3-(8-azaspiro[4.5]decan-8-yl)-2-methyl-N-propan-2-ylbutan-1-amine.
What is the SMILES notation for 3-(8-azaspiro[4.5]decan-8-yl)-2-methyl-N-propan-2-ylbutan-1-amine?
The canonical SMILES for 3-(8-azaspiro[4.5]decan-8-yl)-2-methyl-N-propan-2-ylbutan-1-amine is CC(C)NCC(C)C(C)N1CCC2(CCCC2)CC1.
What is the InChIKey of 3-(8-azaspiro[4.5]decan-8-yl)-2-methyl-N-propan-2-ylbutan-1-amine?
The InChIKey is ALSIEKJQJWAVQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-14(2)18-13-15(3)16(4)19-11-9-17(10-12-19)7-5-6-8-17/h14-16,18H,5-13H2,1-4H3.
What are the key properties of 3-(8-azaspiro[4.5]decan-8-yl)-2-methyl-N-propan-2-ylbutan-1-amine?
3-(8-azaspiro[4.5]decan-8-yl)-2-methyl-N-propan-2-ylbutan-1-amine has a molecular weight of 266.47 g/mol, XLogP of 3.67, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(8-azaspiro[4.5]decan-8-yl)-2-methyl-N-propan-2-ylbutan-1-amine is sourced from PubChem (CID 79409918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).