2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-cyclohexylacetamide

C14H29N3O — CID 79651871

IUPAC2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-cyclohexylacetamide
SMILESCN(CC(=O)NC1CCCCC1)CC(C)(C)CN
InChIInChI=1S/C14H29N3O/c1-14(2,10-15)11-17(3)9-13(18)16-12-7-5-4-6-8-12/h12H,4-11,15H2,1-3H3,(H,16,18)
InChIKeyZFLMTLJEYSRDKB-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.35
Rot. Bonds6

About 2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-cyclohexylacetamide

2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-cyclohexylacetamide (PubChem CID 79651871) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-cyclohexylacetamide.

Molecular Properties

Compound Name2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-cyclohexylacetamide
PubChem CID79651871
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-cyclohexylacetamide
SMILESCN(CC(=O)NC1CCCCC1)CC(C)(C)CN
InChIInChI=1S/C14H29N3O/c1-14(2,10-15)11-17(3)9-13(18)16-12-7-5-4-6-8-12/h12H,4-11,15H2,1-3H3,(H,16,18)
InChIKeyZFLMTLJEYSRDKB-UHFFFAOYSA-N
XLogP1.35
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-cycloheptylacetamide;hydrochloride
CID 119928901
2-[(3-amino-2,2-dimethylpropyl)-propylamino]-N-cycloheptylacetamide
CID 79665477
2-[(1-amino-2-methylbutan-2-yl)-methylamino]-N-cycloheptylacetamide
CID 62548949
2-[(2-amino-2-sulfanylideneethyl)-methylamino]-N-cycloheptylacetamide
CID 55024099
2-[(2-amino-2-sulfanylideneethyl)-methylamino]-N-cyclohexylacetamide
CID 60729940
methyl 2-[[2-(cyclohexylamino)-2-oxoethyl]-methylamino]acetate
CID 55028611
3-[[2-(cyclohexylamino)-2-oxoethyl]-methylamino]propanoic acid
CID 60986544
2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-cyclohexyl-N-ethylacetamide
CID 79652736
N-(3-amino-2,2-dimethylpropyl)-2-(cyclohexylcarbamoylamino)-N-methylacetamide
CID 119656351
2-[(2-amino-2-sulfanylideneethyl)-methylamino]-N-cyclopentylacetamide
CID 60730257
2-[(3-amino-3-sulfanylidenepropyl)-methylamino]-N-cyclohexylacetamide
CID 43186296
N-cyclopentyl-2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]acetamide
CID 78809352

Frequently Asked Questions

What is the IUPAC name of 2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-cyclohexylacetamide?
The IUPAC name of 2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-cyclohexylacetamide (CID 79651871) is 2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-cyclohexylacetamide.
What is the SMILES notation for 2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-cyclohexylacetamide?
The canonical SMILES for 2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-cyclohexylacetamide is CN(CC(=O)NC1CCCCC1)CC(C)(C)CN.
What is the InChIKey of 2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-cyclohexylacetamide?
The InChIKey is ZFLMTLJEYSRDKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-14(2,10-15)11-17(3)9-13(18)16-12-7-5-4-6-8-12/h12H,4-11,15H2,1-3H3,(H,16,18).
What are the key properties of 2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-cyclohexylacetamide?
2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-cyclohexylacetamide has a molecular weight of 255.41 g/mol, XLogP of 1.35, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-cyclohexylacetamide is sourced from PubChem (CID 79651871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).