[2-(aminomethyl)-1,2,3,3-tetraethylcyclobutyl]methanamine

C14H30N2 — CID 19375171

IUPAC[2-(aminomethyl)-1,2,3,3-tetraethylcyclobutyl]methanamine
SMILESCCC1(CC)CC(CC)(CN)C1(CC)CN
InChIInChI=1S/C14H30N2/c1-5-12(6-2)9-13(7-3,10-15)14(12,8-4)11-16/h5-11,15-16H2,1-4H3
InChIKeyLVRSWAGITRPSKQ-UHFFFAOYSA-N
MW226.41 g/mol
LogP2.91
Rot. Bonds6

About [2-(aminomethyl)-1,2,3,3-tetraethylcyclobutyl]methanamine

[2-(aminomethyl)-1,2,3,3-tetraethylcyclobutyl]methanamine (PubChem CID 19375171) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is [2-(aminomethyl)-1,2,3,3-tetraethylcyclobutyl]methanamine.

Molecular Properties

Compound Name[2-(aminomethyl)-1,2,3,3-tetraethylcyclobutyl]methanamine
PubChem CID19375171
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name[2-(aminomethyl)-1,2,3,3-tetraethylcyclobutyl]methanamine
SMILESCCC1(CC)CC(CC)(CN)C1(CC)CN
InChIInChI=1S/C14H30N2/c1-5-12(6-2)9-13(7-3,10-15)14(12,8-4)11-16/h5-11,15-16H2,1-4H3
InChIKeyLVRSWAGITRPSKQ-UHFFFAOYSA-N
XLogP2.91
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-(aminomethyl)-1,2,3,3-tetraethylcyclobutyl]methanamine?
The IUPAC name of [2-(aminomethyl)-1,2,3,3-tetraethylcyclobutyl]methanamine (CID 19375171) is [2-(aminomethyl)-1,2,3,3-tetraethylcyclobutyl]methanamine.
What is the SMILES notation for [2-(aminomethyl)-1,2,3,3-tetraethylcyclobutyl]methanamine?
The canonical SMILES for [2-(aminomethyl)-1,2,3,3-tetraethylcyclobutyl]methanamine is CCC1(CC)CC(CC)(CN)C1(CC)CN.
What is the InChIKey of [2-(aminomethyl)-1,2,3,3-tetraethylcyclobutyl]methanamine?
The InChIKey is LVRSWAGITRPSKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-5-12(6-2)9-13(7-3,10-15)14(12,8-4)11-16/h5-11,15-16H2,1-4H3.
What are the key properties of [2-(aminomethyl)-1,2,3,3-tetraethylcyclobutyl]methanamine?
[2-(aminomethyl)-1,2,3,3-tetraethylcyclobutyl]methanamine has a molecular weight of 226.41 g/mol, XLogP of 2.91, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(aminomethyl)-1,2,3,3-tetraethylcyclobutyl]methanamine is sourced from PubChem (CID 19375171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).