(2R)-2-amino-N-(2,2-dimethylcyclohexyl)butanamide

C12H24N2O — CID 79878292

IUPAC(2R)-2-amino-N-(2,2-dimethylcyclohexyl)butanamide
SMILESCC[C@@H](N)C(=O)NC1CCCCC1(C)C
InChIInChI=1S/C12H24N2O/c1-4-9(13)11(15)14-10-7-5-6-8-12(10,2)3/h9-10H,4-8,13H2,1-3H3,(H,14,15)/t9-,10?/m1/s1
InChIKeyVLVRGYMUAOGSOF-YHMJZVADSA-N
MW212.34 g/mol
LogP1.81
Rot. Bonds3

About (2R)-2-amino-N-(2,2-dimethylcyclohexyl)butanamide

(2R)-2-amino-N-(2,2-dimethylcyclohexyl)butanamide (PubChem CID 79878292) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is (2R)-2-amino-N-(2,2-dimethylcyclohexyl)butanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(2,2-dimethylcyclohexyl)butanamide
PubChem CID79878292
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name(2R)-2-amino-N-(2,2-dimethylcyclohexyl)butanamide
SMILESCC[C@@H](N)C(=O)NC1CCCCC1(C)C
InChIInChI=1S/C12H24N2O/c1-4-9(13)11(15)14-10-7-5-6-8-12(10,2)3/h9-10H,4-8,13H2,1-3H3,(H,14,15)/t9-,10?/m1/s1
InChIKeyVLVRGYMUAOGSOF-YHMJZVADSA-N
XLogP1.81
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-(2,2-dimethylcyclohexyl)pentanamide
CID 79877969
2-amino-N-(2,2-dimethylcyclohexyl)-4-methylpentanamide
CID 79878464
4-amino-5-[(2,2-dimethylcyclohexyl)amino]-5-oxopentanoic acid
CID 79878132
(2S)-2-amino-N-(2,2-dimethylcyclopentyl)hexanamide
CID 103831777
N-(2,2-dimethylcyclohexyl)-2-(N'-hydroxycarbamimidoyl)butanamide
CID 79872938
N-(2,2-dimethylcyclopentyl)-2-sulfanylbutanamide
CID 131177062
4-amino-N-(2,2-dimethylcyclohexyl)pentanamide;hydrochloride
CID 120562889
2-cyano-N-(2,2-dimethylcyclohexyl)propanamide
CID 79877982
2-(aminomethyl)-N-(2,2-dimethylcyclopentyl)pentanamide
CID 79870952
N-(2,2-dimethylcyclopentyl)propanamide;ethane
CID 171523007
(2R)-2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)butanamide
CID 104940471
3-chloro-N-(2,2-dimethylcyclohexyl)propanamide
CID 79870321

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(2,2-dimethylcyclohexyl)butanamide?
The IUPAC name of (2R)-2-amino-N-(2,2-dimethylcyclohexyl)butanamide (CID 79878292) is (2R)-2-amino-N-(2,2-dimethylcyclohexyl)butanamide.
What is the SMILES notation for (2R)-2-amino-N-(2,2-dimethylcyclohexyl)butanamide?
The canonical SMILES for (2R)-2-amino-N-(2,2-dimethylcyclohexyl)butanamide is CC[C@@H](N)C(=O)NC1CCCCC1(C)C.
What is the InChIKey of (2R)-2-amino-N-(2,2-dimethylcyclohexyl)butanamide?
The InChIKey is VLVRGYMUAOGSOF-YHMJZVADSA-N. The full InChI is InChI=1S/C12H24N2O/c1-4-9(13)11(15)14-10-7-5-6-8-12(10,2)3/h9-10H,4-8,13H2,1-3H3,(H,14,15)/t9-,10?/m1/s1.
What are the key properties of (2R)-2-amino-N-(2,2-dimethylcyclohexyl)butanamide?
(2R)-2-amino-N-(2,2-dimethylcyclohexyl)butanamide has a molecular weight of 212.34 g/mol, XLogP of 1.81, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(2,2-dimethylcyclohexyl)butanamide is sourced from PubChem (CID 79878292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).