2-(aminomethyl)-5-ethyl-N-methyl-N-propan-2-ylcyclohexan-1-amine

C13H28N2 — CID 43293397

IUPAC2-(aminomethyl)-5-ethyl-N-methyl-N-propan-2-ylcyclohexan-1-amine
SMILESCCC1CCC(CN)C(N(C)C(C)C)C1
InChIInChI=1S/C13H28N2/c1-5-11-6-7-12(9-14)13(8-11)15(4)10(2)3/h10-13H,5-9,14H2,1-4H3
InChIKeyCSUUKJGHUTWGCO-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.48
Rot. Bonds4

About 2-(aminomethyl)-5-ethyl-N-methyl-N-propan-2-ylcyclohexan-1-amine

2-(aminomethyl)-5-ethyl-N-methyl-N-propan-2-ylcyclohexan-1-amine (PubChem CID 43293397) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 2-(aminomethyl)-5-ethyl-N-methyl-N-propan-2-ylcyclohexan-1-amine.

Molecular Properties

Compound Name2-(aminomethyl)-5-ethyl-N-methyl-N-propan-2-ylcyclohexan-1-amine
PubChem CID43293397
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name2-(aminomethyl)-5-ethyl-N-methyl-N-propan-2-ylcyclohexan-1-amine
SMILESCCC1CCC(CN)C(N(C)C(C)C)C1
InChIInChI=1S/C13H28N2/c1-5-11-6-7-12(9-14)13(8-11)15(4)10(2)3/h10-13H,5-9,14H2,1-4H3
InChIKeyCSUUKJGHUTWGCO-UHFFFAOYSA-N
XLogP2.48
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(aminomethyl)-5-ethyl-N-methyl-N-(3-methylbutan-2-yl)cyclohexan-1-amine
CID 43569707
4-ethyl-2-N-methyl-2-N-propan-2-ylcyclohexane-1,2-diamine
CID 16781866
2-(aminomethyl)-5-tert-butyl-N-methyl-N-propan-2-ylcyclohexan-1-amine
CID 43293395
2-(aminomethyl)-N-cyclopropyl-5-ethyl-N-(2-methylpropyl)cyclohexan-1-amine
CID 55002153
2-(aminomethyl)-N-cyclohexyl-5-ethyl-N-methylcyclohexan-1-amine
CID 43329364
N-[2-(aminomethyl)-5-ethylcyclohexyl]-N-methylcycloheptanamine
CID 43613832
2-(aminomethyl)-N-methyl-N-(4-methylpentan-2-yl)-5-propylcyclohexan-1-amine
CID 63404191
2-(aminomethyl)-N-methyl-N-propan-2-ylcyclopentan-1-amine
CID 43293401
2-(aminomethyl)-5-ethyl-N-(2-methoxyethyl)-N-methylcyclohexan-1-amine
CID 61427073
2-(aminomethyl)-N-butan-2-yl-5-ethyl-N-(2-methoxyethyl)cyclohexan-1-amine
CID 55001186
2-(aminomethyl)-5-ethyl-N-methyl-N-(oxolan-2-ylmethyl)cyclohexan-1-amine
CID 61431165
2-(aminomethyl)-N-(cyclopropylmethyl)-5-ethyl-N-propylcyclohexan-1-amine
CID 43478976

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-5-ethyl-N-methyl-N-propan-2-ylcyclohexan-1-amine?
The IUPAC name of 2-(aminomethyl)-5-ethyl-N-methyl-N-propan-2-ylcyclohexan-1-amine (CID 43293397) is 2-(aminomethyl)-5-ethyl-N-methyl-N-propan-2-ylcyclohexan-1-amine.
What is the SMILES notation for 2-(aminomethyl)-5-ethyl-N-methyl-N-propan-2-ylcyclohexan-1-amine?
The canonical SMILES for 2-(aminomethyl)-5-ethyl-N-methyl-N-propan-2-ylcyclohexan-1-amine is CCC1CCC(CN)C(N(C)C(C)C)C1.
What is the InChIKey of 2-(aminomethyl)-5-ethyl-N-methyl-N-propan-2-ylcyclohexan-1-amine?
The InChIKey is CSUUKJGHUTWGCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-5-11-6-7-12(9-14)13(8-11)15(4)10(2)3/h10-13H,5-9,14H2,1-4H3.
What are the key properties of 2-(aminomethyl)-5-ethyl-N-methyl-N-propan-2-ylcyclohexan-1-amine?
2-(aminomethyl)-5-ethyl-N-methyl-N-propan-2-ylcyclohexan-1-amine has a molecular weight of 212.38 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-5-ethyl-N-methyl-N-propan-2-ylcyclohexan-1-amine is sourced from PubChem (CID 43293397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).