2-(8-azaspiro[4.5]decan-8-yl)-N-prop-2-ynylpropan-1-amine

C15H26N2 — CID 63163175

IUPAC2-(8-azaspiro[4.5]decan-8-yl)-N-prop-2-ynylpropan-1-amine
SMILESC#CCNCC(C)N1CCC2(CCCC2)CC1
InChIInChI=1S/C15H26N2/c1-3-10-16-13-14(2)17-11-8-15(9-12-17)6-4-5-7-15/h1,14,16H,4-13H2,2H3
InChIKeyOWGATZBIRONNNY-UHFFFAOYSA-N
MW234.39 g/mol
LogP2.25
Rot. Bonds4

About 2-(8-azaspiro[4.5]decan-8-yl)-N-prop-2-ynylpropan-1-amine

2-(8-azaspiro[4.5]decan-8-yl)-N-prop-2-ynylpropan-1-amine (PubChem CID 63163175) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is 2-(8-azaspiro[4.5]decan-8-yl)-N-prop-2-ynylpropan-1-amine.

Molecular Properties

Compound Name2-(8-azaspiro[4.5]decan-8-yl)-N-prop-2-ynylpropan-1-amine
PubChem CID63163175
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC Name2-(8-azaspiro[4.5]decan-8-yl)-N-prop-2-ynylpropan-1-amine
SMILESC#CCNCC(C)N1CCC2(CCCC2)CC1
InChIInChI=1S/C15H26N2/c1-3-10-16-13-14(2)17-11-8-15(9-12-17)6-4-5-7-15/h1,14,16H,4-13H2,2H3
InChIKeyOWGATZBIRONNNY-UHFFFAOYSA-N
XLogP2.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

2-(7,7-dimethyl-1,4-thiazepan-4-yl)-N-prop-2-ynylpropan-1-amine
CID 107459661
2-(8-azaspiro[4.5]decan-8-yl)-N-methylpropan-1-amine
CID 63163571
2-(4-methyl-1,4-diazepan-1-yl)-N-prop-2-ynylpropan-1-amine
CID 62558175
2-(8-azaspiro[4.5]decan-8-yl)-N-(oxolan-2-ylmethyl)propan-1-amine
CID 63163669
3-(8-azaspiro[4.5]decan-8-yl)-2-methyl-N-propan-2-ylbutan-1-amine
CID 79409918
2-(8-azaspiro[4.5]decan-8-yl)-3-methyl-N-propan-2-ylbutan-1-amine
CID 63163539
3-(8-azaspiro[4.5]decan-8-yl)butanoic acid
CID 63158284
3-(8-azaspiro[4.5]decan-8-yl)-N,2-dimethylbutan-1-amine
CID 79409713
2-(8-azaspiro[4.5]decan-8-yl)-N-ethylbutan-1-amine
CID 63163660
2-[4-(2-fluorophenyl)piperazin-1-yl]-N-prop-2-ynylpropan-1-amine
CID 62556416
2-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-N-prop-2-ynylpropan-1-amine
CID 65322633
3-(6-azaspiro[2.5]octan-6-yl)butanenitrile
CID 126990250

Frequently Asked Questions

What is the IUPAC name of 2-(8-azaspiro[4.5]decan-8-yl)-N-prop-2-ynylpropan-1-amine?
The IUPAC name of 2-(8-azaspiro[4.5]decan-8-yl)-N-prop-2-ynylpropan-1-amine (CID 63163175) is 2-(8-azaspiro[4.5]decan-8-yl)-N-prop-2-ynylpropan-1-amine.
What is the SMILES notation for 2-(8-azaspiro[4.5]decan-8-yl)-N-prop-2-ynylpropan-1-amine?
The canonical SMILES for 2-(8-azaspiro[4.5]decan-8-yl)-N-prop-2-ynylpropan-1-amine is C#CCNCC(C)N1CCC2(CCCC2)CC1.
What is the InChIKey of 2-(8-azaspiro[4.5]decan-8-yl)-N-prop-2-ynylpropan-1-amine?
The InChIKey is OWGATZBIRONNNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-3-10-16-13-14(2)17-11-8-15(9-12-17)6-4-5-7-15/h1,14,16H,4-13H2,2H3.
What are the key properties of 2-(8-azaspiro[4.5]decan-8-yl)-N-prop-2-ynylpropan-1-amine?
2-(8-azaspiro[4.5]decan-8-yl)-N-prop-2-ynylpropan-1-amine has a molecular weight of 234.39 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-azaspiro[4.5]decan-8-yl)-N-prop-2-ynylpropan-1-amine is sourced from PubChem (CID 63163175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).