2-(aminomethyl)-N-cyclohexyl-N-ethyl-2-methylbutanamide

C14H28N2O — CID 114290173

IUPAC2-(aminomethyl)-N-cyclohexyl-N-ethyl-2-methylbutanamide
SMILESCCN(C(=O)C(C)(CC)CN)C1CCCCC1
InChIInChI=1S/C14H28N2O/c1-4-14(3,11-15)13(17)16(5-2)12-9-7-6-8-10-12/h12H,4-11,15H2,1-3H3
InChIKeyINKMLCIAIMVBBV-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.54
Rot. Bonds5

About 2-(aminomethyl)-N-cyclohexyl-N-ethyl-2-methylbutanamide

2-(aminomethyl)-N-cyclohexyl-N-ethyl-2-methylbutanamide (PubChem CID 114290173) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-(aminomethyl)-N-cyclohexyl-N-ethyl-2-methylbutanamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-cyclohexyl-N-ethyl-2-methylbutanamide
PubChem CID114290173
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-(aminomethyl)-N-cyclohexyl-N-ethyl-2-methylbutanamide
SMILESCCN(C(=O)C(C)(CC)CN)C1CCCCC1
InChIInChI=1S/C14H28N2O/c1-4-14(3,11-15)13(17)16(5-2)12-9-7-6-8-10-12/h12H,4-11,15H2,1-3H3
InChIKeyINKMLCIAIMVBBV-UHFFFAOYSA-N
XLogP2.54
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(aminomethyl)-N-cyclobutyl-N-(2-hydroxyethyl)-2-methylbutanamide
CID 102861281
2-(aminomethyl)-N-cyclobutyl-N-(3-hydroxypropyl)-2-methylbutanamide
CID 102861246
2-amino-N-cyclohexyl-N-ethyl-2-methylpropanamide
CID 56831871
2-(aminomethyl)-N-cyclopropyl-2-methyl-N-(2,2,2-trifluoroethyl)butanamide
CID 114290544
N-cyclopentyl-N-ethyl-2-(N'-hydroxycarbamimidoyl)-2-methylbutanamide
CID 114292655
N-cyclohexyl-N-ethyl-2-(ethylamino)-2-methylpropanamide
CID 62831377
2-amino-N-cyclopentyl-N-ethyl-3,3,3-trifluoro-2-methylpropanamide
CID 79796711
N-cyclopentyl-N-ethyl-2-methyl-2-(methylamino)propanamide
CID 62836195
2-(aminomethyl)-N-(cyclopropylmethyl)-N-ethyl-2-methylbutanamide
CID 114290733
2-(aminomethyl)-N-(4,4-dimethylcyclohexyl)-N,2-dimethylbutanamide
CID 114290836
3-amino-N-cyclohexyl-N-ethylpropanamide
CID 16786481
2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-cyclohexyl-N-ethylacetamide
CID 79652736

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-cyclohexyl-N-ethyl-2-methylbutanamide?
The IUPAC name of 2-(aminomethyl)-N-cyclohexyl-N-ethyl-2-methylbutanamide (CID 114290173) is 2-(aminomethyl)-N-cyclohexyl-N-ethyl-2-methylbutanamide.
What is the SMILES notation for 2-(aminomethyl)-N-cyclohexyl-N-ethyl-2-methylbutanamide?
The canonical SMILES for 2-(aminomethyl)-N-cyclohexyl-N-ethyl-2-methylbutanamide is CCN(C(=O)C(C)(CC)CN)C1CCCCC1.
What is the InChIKey of 2-(aminomethyl)-N-cyclohexyl-N-ethyl-2-methylbutanamide?
The InChIKey is INKMLCIAIMVBBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-4-14(3,11-15)13(17)16(5-2)12-9-7-6-8-10-12/h12H,4-11,15H2,1-3H3.
What are the key properties of 2-(aminomethyl)-N-cyclohexyl-N-ethyl-2-methylbutanamide?
2-(aminomethyl)-N-cyclohexyl-N-ethyl-2-methylbutanamide has a molecular weight of 240.39 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-cyclohexyl-N-ethyl-2-methylbutanamide is sourced from PubChem (CID 114290173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).