8-(aminomethyl)-N-methyl-N-(2-methylbutyl)spiro[4.5]decan-8-amine

C17H34N2 — CID 114818035

IUPAC8-(aminomethyl)-N-methyl-N-(2-methylbutyl)spiro[4.5]decan-8-amine
SMILESCCC(C)CN(C)C1(CN)CCC2(CCCC2)CC1
InChIInChI=1S/C17H34N2/c1-4-15(2)13-19(3)17(14-18)11-9-16(10-12-17)7-5-6-8-16/h15H,4-14,18H2,1-3H3
InChIKeyAEGZOMYKSSAPOE-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.80
Rot. Bonds5

About 8-(aminomethyl)-N-methyl-N-(2-methylbutyl)spiro[4.5]decan-8-amine

8-(aminomethyl)-N-methyl-N-(2-methylbutyl)spiro[4.5]decan-8-amine (PubChem CID 114818035) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 8-(aminomethyl)-N-methyl-N-(2-methylbutyl)spiro[4.5]decan-8-amine.

Molecular Properties

Compound Name8-(aminomethyl)-N-methyl-N-(2-methylbutyl)spiro[4.5]decan-8-amine
PubChem CID114818035
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name8-(aminomethyl)-N-methyl-N-(2-methylbutyl)spiro[4.5]decan-8-amine
SMILESCCC(C)CN(C)C1(CN)CCC2(CCCC2)CC1
InChIInChI=1S/C17H34N2/c1-4-15(2)13-19(3)17(14-18)11-9-16(10-12-17)7-5-6-8-16/h15H,4-14,18H2,1-3H3
InChIKeyAEGZOMYKSSAPOE-UHFFFAOYSA-N
XLogP3.80
TPSA29.26 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 ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(aminomethyl)-N,4-dimethyl-N-(2-methylbutyl)cycloheptan-1-amine
CID 65084874
1-(aminomethyl)-N,3-dimethyl-N-(2-methylbutyl)cyclobutan-1-amine
CID 103562600
1-(aminomethyl)-N,3,3,5,5-pentamethyl-N-(2-methylbutyl)cyclohexan-1-amine
CID 112682327
1-(aminomethyl)-N-methyl-N-(2-methylpropyl)cyclopentan-1-amine
CID 43271983
3-(aminomethyl)-N-methyl-N-(2-methylbutyl)thiolan-3-amine
CID 43295596
8-(aminomethyl)-N,N-dimethylspiro[4.5]decan-8-amine
CID 114818017
1-(aminomethyl)-N,2,2-trimethyl-N-(2-methylbutyl)cyclopentan-1-amine
CID 79858006
1-(aminomethyl)-N-methyl-N-(2-methylpropyl)cyclododecan-1-amine
CID 43271985
8-(aminomethyl)-N,N-diethylspiro[4.5]decan-8-amine
CID 114817997
1-(aminomethyl)-N-(2-methylbutyl)-N-propylcyclohexan-1-amine
CID 62105853
1-(aminomethyl)-N-methyl-N-(3-methylbutyl)cyclopentan-1-amine
CID 61426013
8-(aminomethyl)-N-butan-2-yl-N-(2-methoxyethyl)spiro[4.5]decan-8-amine
CID 114818099

Frequently Asked Questions

What is the IUPAC name of 8-(aminomethyl)-N-methyl-N-(2-methylbutyl)spiro[4.5]decan-8-amine?
The IUPAC name of 8-(aminomethyl)-N-methyl-N-(2-methylbutyl)spiro[4.5]decan-8-amine (CID 114818035) is 8-(aminomethyl)-N-methyl-N-(2-methylbutyl)spiro[4.5]decan-8-amine.
What is the SMILES notation for 8-(aminomethyl)-N-methyl-N-(2-methylbutyl)spiro[4.5]decan-8-amine?
The canonical SMILES for 8-(aminomethyl)-N-methyl-N-(2-methylbutyl)spiro[4.5]decan-8-amine is CCC(C)CN(C)C1(CN)CCC2(CCCC2)CC1.
What is the InChIKey of 8-(aminomethyl)-N-methyl-N-(2-methylbutyl)spiro[4.5]decan-8-amine?
The InChIKey is AEGZOMYKSSAPOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-4-15(2)13-19(3)17(14-18)11-9-16(10-12-17)7-5-6-8-16/h15H,4-14,18H2,1-3H3.
What are the key properties of 8-(aminomethyl)-N-methyl-N-(2-methylbutyl)spiro[4.5]decan-8-amine?
8-(aminomethyl)-N-methyl-N-(2-methylbutyl)spiro[4.5]decan-8-amine has a molecular weight of 266.47 g/mol, XLogP of 3.80, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(aminomethyl)-N-methyl-N-(2-methylbutyl)spiro[4.5]decan-8-amine is sourced from PubChem (CID 114818035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).