3-(aminomethyl)-3-ethyl-5,5-dimethylcyclohexan-1-amine

C11H24N2 — CID 123365442

IUPAC3-(aminomethyl)-3-ethyl-5,5-dimethylcyclohexan-1-amine
SMILESCCC1(CN)CC(N)CC(C)(C)C1
InChIInChI=1S/C11H24N2/c1-4-11(8-12)6-9(13)5-10(2,3)7-11/h9H,4-8,12-13H2,1-3H3
InChIKeyMIHPNUVYIOBAPF-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.88
Rot. Bonds2

About 3-(aminomethyl)-3-ethyl-5,5-dimethylcyclohexan-1-amine

3-(aminomethyl)-3-ethyl-5,5-dimethylcyclohexan-1-amine (PubChem CID 123365442) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is 3-(aminomethyl)-3-ethyl-5,5-dimethylcyclohexan-1-amine.

Molecular Properties

Compound Name3-(aminomethyl)-3-ethyl-5,5-dimethylcyclohexan-1-amine
PubChem CID123365442
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Name3-(aminomethyl)-3-ethyl-5,5-dimethylcyclohexan-1-amine
SMILESCCC1(CN)CC(N)CC(C)(C)C1
InChIInChI=1S/C11H24N2/c1-4-11(8-12)6-9(13)5-10(2,3)7-11/h9H,4-8,12-13H2,1-3H3
InChIKeyMIHPNUVYIOBAPF-UHFFFAOYSA-N
XLogP1.88
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

methanamine;3,3,5,5-tetramethylcyclohexan-1-amine
CID 144937485
3,3-dimethylcyclobutan-1-amine
CID 14988402
3-ethyl-3-methylcyclobutan-1-amine
CID 121388624
3,3-diethylcyclopentan-1-amine;methanol
CID 174812528
[(1S)-1-ethyl-3-methylcyclopentyl]methanamine
CID 142068635
3-(aminomethyl)-3,5,5-trimethylcyclohexan-1-amine;dimethyl (Z)-but-2-enedioate
CID 6442112
3-[(butan-2-ylideneamino)methyl]-3,5,5-trimethylcyclohexan-1-amine
CID 101150455
1-butyl-2,2,6,6-tetramethylpiperidin-4-amine
CID 19905643
(1,2,4,4-tetramethylcyclopentyl)methanamine
CID 131550173
(1-ethylcyclooctyl)methanamine
CID 80604065
3-amino-1-ethylcyclobutan-1-ol
CID 80561372
[2-[1-(aminomethyl)-3,3-diethylcyclopentyl]acetyl] 2-[1-(aminomethyl)-3,3-dimethylcyclopentyl]acetate
CID 90869255

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-3-ethyl-5,5-dimethylcyclohexan-1-amine?
The IUPAC name of 3-(aminomethyl)-3-ethyl-5,5-dimethylcyclohexan-1-amine (CID 123365442) is 3-(aminomethyl)-3-ethyl-5,5-dimethylcyclohexan-1-amine.
What is the SMILES notation for 3-(aminomethyl)-3-ethyl-5,5-dimethylcyclohexan-1-amine?
The canonical SMILES for 3-(aminomethyl)-3-ethyl-5,5-dimethylcyclohexan-1-amine is CCC1(CN)CC(N)CC(C)(C)C1.
What is the InChIKey of 3-(aminomethyl)-3-ethyl-5,5-dimethylcyclohexan-1-amine?
The InChIKey is MIHPNUVYIOBAPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-4-11(8-12)6-9(13)5-10(2,3)7-11/h9H,4-8,12-13H2,1-3H3.
What are the key properties of 3-(aminomethyl)-3-ethyl-5,5-dimethylcyclohexan-1-amine?
3-(aminomethyl)-3-ethyl-5,5-dimethylcyclohexan-1-amine has a molecular weight of 184.33 g/mol, XLogP of 1.88, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-3-ethyl-5,5-dimethylcyclohexan-1-amine is sourced from PubChem (CID 123365442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).