3-(aminomethyl)-N-ethyl-2,2,5,5-tetramethyl-N-(2-methylpropyl)oxolan-3-amine

C15H32N2O — CID 79928078

IUPAC3-(aminomethyl)-N-ethyl-2,2,5,5-tetramethyl-N-(2-methylpropyl)oxolan-3-amine
SMILESCCN(CC(C)C)C1(CN)CC(C)(C)OC1(C)C
InChIInChI=1S/C15H32N2O/c1-8-17(9-12(2)3)15(11-16)10-13(4,5)18-14(15,6)7/h12H,8-11,16H2,1-7H3
InChIKeyAOYYKQIEQISBJN-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.64
Rot. Bonds5

About 3-(aminomethyl)-N-ethyl-2,2,5,5-tetramethyl-N-(2-methylpropyl)oxolan-3-amine

3-(aminomethyl)-N-ethyl-2,2,5,5-tetramethyl-N-(2-methylpropyl)oxolan-3-amine (PubChem CID 79928078) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is 3-(aminomethyl)-N-ethyl-2,2,5,5-tetramethyl-N-(2-methylpropyl)oxolan-3-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N-ethyl-2,2,5,5-tetramethyl-N-(2-methylpropyl)oxolan-3-amine
PubChem CID79928078
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name3-(aminomethyl)-N-ethyl-2,2,5,5-tetramethyl-N-(2-methylpropyl)oxolan-3-amine
SMILESCCN(CC(C)C)C1(CN)CC(C)(C)OC1(C)C
InChIInChI=1S/C15H32N2O/c1-8-17(9-12(2)3)15(11-16)10-13(4,5)18-14(15,6)7/h12H,8-11,16H2,1-7H3
InChIKeyAOYYKQIEQISBJN-UHFFFAOYSA-N
XLogP2.64
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(aminomethyl)-N-ethyl-2,2-dimethyl-N-(2-methylpropyl)cyclohexan-1-amine
CID 79836992
3-(aminomethyl)-N,2,2,5,5-pentamethyl-N-(1-methylsulfanylbutan-2-yl)oxolan-3-amine
CID 112658428
3-(aminomethyl)-N-(cyclopropylmethyl)-N,2,2,5,5-pentamethyloxolan-3-amine
CID 79928081
1-(aminomethyl)-N-ethyl-4,4-dimethyl-N-(2-methylpropyl)cycloheptan-1-amine
CID 65087963
3-(aminomethyl)-N,2,2,5,5-pentamethyl-N-[(2-methylcyclopropyl)methyl]oxolan-3-amine
CID 79927059
3-(aminomethyl)-N-(3-methoxypropyl)-N,2,2,5,5-pentamethyloxolan-3-amine
CID 79928522
3-(aminomethyl)-N,2,2,5,5-pentamethyl-N-(oxolan-3-yl)oxolan-3-amine
CID 82734683
1-(aminomethyl)-N,3,3,5,5-pentamethyl-N-(2-methylpropyl)cyclohexan-1-amine
CID 112682322
1-(aminomethyl)-N-ethyl-N-(2-methylpropyl)-4-propylcyclohexan-1-amine
CID 63471543
1-(aminomethyl)-N-ethyl-3,3,5,5-tetramethyl-N-(2-methylbutyl)cyclohexan-1-amine
CID 115999151
3-(aminomethyl)-N-(2-bicyclo[2.2.1]heptanylmethyl)-N,2,2,5,5-pentamethyloxolan-3-amine
CID 79912262
1-(aminomethyl)-N-ethyl-N,3-bis(2-methylpropyl)cyclohexan-1-amine
CID 107428924

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N-ethyl-2,2,5,5-tetramethyl-N-(2-methylpropyl)oxolan-3-amine?
The IUPAC name of 3-(aminomethyl)-N-ethyl-2,2,5,5-tetramethyl-N-(2-methylpropyl)oxolan-3-amine (CID 79928078) is 3-(aminomethyl)-N-ethyl-2,2,5,5-tetramethyl-N-(2-methylpropyl)oxolan-3-amine.
What is the SMILES notation for 3-(aminomethyl)-N-ethyl-2,2,5,5-tetramethyl-N-(2-methylpropyl)oxolan-3-amine?
The canonical SMILES for 3-(aminomethyl)-N-ethyl-2,2,5,5-tetramethyl-N-(2-methylpropyl)oxolan-3-amine is CCN(CC(C)C)C1(CN)CC(C)(C)OC1(C)C.
What is the InChIKey of 3-(aminomethyl)-N-ethyl-2,2,5,5-tetramethyl-N-(2-methylpropyl)oxolan-3-amine?
The InChIKey is AOYYKQIEQISBJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-8-17(9-12(2)3)15(11-16)10-13(4,5)18-14(15,6)7/h12H,8-11,16H2,1-7H3.
What are the key properties of 3-(aminomethyl)-N-ethyl-2,2,5,5-tetramethyl-N-(2-methylpropyl)oxolan-3-amine?
3-(aminomethyl)-N-ethyl-2,2,5,5-tetramethyl-N-(2-methylpropyl)oxolan-3-amine has a molecular weight of 256.43 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N-ethyl-2,2,5,5-tetramethyl-N-(2-methylpropyl)oxolan-3-amine is sourced from PubChem (CID 79928078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).