3-(8-ethyl-6,9-diazaspiro[4.5]decan-9-yl)-N,N-dimethylbutan-1-amine

C16H33N3 — CID 64947270

IUPAC3-(8-ethyl-6,9-diazaspiro[4.5]decan-9-yl)-N,N-dimethylbutan-1-amine
SMILESCCC1CNC2(CCCC2)CN1C(C)CCN(C)C
InChIInChI=1S/C16H33N3/c1-5-15-12-17-16(9-6-7-10-16)13-19(15)14(2)8-11-18(3)4/h14-15,17H,5-13H2,1-4H3
InChIKeyPKAZJXJEENDGQO-UHFFFAOYSA-N
MW267.46 g/mol
LogP2.32
Rot. Bonds5

About 3-(8-ethyl-6,9-diazaspiro[4.5]decan-9-yl)-N,N-dimethylbutan-1-amine

3-(8-ethyl-6,9-diazaspiro[4.5]decan-9-yl)-N,N-dimethylbutan-1-amine (PubChem CID 64947270) has the molecular formula C16H33N3 and a molecular weight of 267.46 g/mol. Its IUPAC name is 3-(8-ethyl-6,9-diazaspiro[4.5]decan-9-yl)-N,N-dimethylbutan-1-amine.

Molecular Properties

Compound Name3-(8-ethyl-6,9-diazaspiro[4.5]decan-9-yl)-N,N-dimethylbutan-1-amine
PubChem CID64947270
Molecular FormulaC16H33N3
Molecular Weight267.46 g/mol
Exact Mass267.27
IUPAC Name3-(8-ethyl-6,9-diazaspiro[4.5]decan-9-yl)-N,N-dimethylbutan-1-amine
SMILESCCC1CNC2(CCCC2)CN1C(C)CCN(C)C
InChIInChI=1S/C16H33N3/c1-5-15-12-17-16(9-6-7-10-16)13-19(15)14(2)8-11-18(3)4/h14-15,17H,5-13H2,1-4H3
InChIKeyPKAZJXJEENDGQO-UHFFFAOYSA-N
XLogP2.32
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.46
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

8-ethyl-9-pentan-2-yl-6,9-diazaspiro[4.5]decane
CID 64930793
8-ethyl-9-octan-2-yl-6,9-diazaspiro[4.5]decane
CID 64946256
3-ethyl-4-hexan-3-yl-1,4-diazaspiro[5.5]undecane
CID 64945645
4-(3-ethyl-1,4-diazaspiro[5.5]undecan-4-yl)-N,N-dimethylbutan-1-amine
CID 64945821
8-ethyl-9-[1-(4-methylphenyl)ethyl]-6,9-diazaspiro[4.5]decane
CID 64948229
8-ethyl-9-pent-1-yn-3-yl-6,9-diazaspiro[4.5]decane
CID 106224522
2-ethyl-5,5-dimethyl-1-pentan-2-ylpiperazine
CID 64931991
4-[1-(8-ethyl-6,9-diazaspiro[4.5]decan-9-yl)ethyl]-3,5-dimethyl-1,2-oxazole
CID 79231699
9-[1-(2,5-dimethylthiophen-3-yl)ethyl]-8-ethyl-6,9-diazaspiro[4.5]decane
CID 64948572
4-(5-methylhexan-2-yl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane
CID 64939492
9-octan-2-yl-8-propan-2-yl-6,9-diazaspiro[4.5]decane
CID 64947217
8-methyl-9-(2-methylpentan-3-yl)-6,9-diazaspiro[4.5]decane
CID 64947965

Frequently Asked Questions

What is the IUPAC name of 3-(8-ethyl-6,9-diazaspiro[4.5]decan-9-yl)-N,N-dimethylbutan-1-amine?
The IUPAC name of 3-(8-ethyl-6,9-diazaspiro[4.5]decan-9-yl)-N,N-dimethylbutan-1-amine (CID 64947270) is 3-(8-ethyl-6,9-diazaspiro[4.5]decan-9-yl)-N,N-dimethylbutan-1-amine.
What is the SMILES notation for 3-(8-ethyl-6,9-diazaspiro[4.5]decan-9-yl)-N,N-dimethylbutan-1-amine?
The canonical SMILES for 3-(8-ethyl-6,9-diazaspiro[4.5]decan-9-yl)-N,N-dimethylbutan-1-amine is CCC1CNC2(CCCC2)CN1C(C)CCN(C)C.
What is the InChIKey of 3-(8-ethyl-6,9-diazaspiro[4.5]decan-9-yl)-N,N-dimethylbutan-1-amine?
The InChIKey is PKAZJXJEENDGQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3/c1-5-15-12-17-16(9-6-7-10-16)13-19(15)14(2)8-11-18(3)4/h14-15,17H,5-13H2,1-4H3.
What are the key properties of 3-(8-ethyl-6,9-diazaspiro[4.5]decan-9-yl)-N,N-dimethylbutan-1-amine?
3-(8-ethyl-6,9-diazaspiro[4.5]decan-9-yl)-N,N-dimethylbutan-1-amine has a molecular weight of 267.46 g/mol, XLogP of 2.32, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(8-ethyl-6,9-diazaspiro[4.5]decan-9-yl)-N,N-dimethylbutan-1-amine is sourced from PubChem (CID 64947270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).