2-[(5-hydroxy-2,2-dimethylpentyl)amino]-N-(2-methylbutan-2-yl)acetamide

C14H30N2O2 — CID 106147113

IUPAC2-[(5-hydroxy-2,2-dimethylpentyl)amino]-N-(2-methylbutan-2-yl)acetamide
SMILESCCC(C)(C)NC(=O)CNCC(C)(C)CCCO
InChIInChI=1S/C14H30N2O2/c1-6-14(4,5)16-12(18)10-15-11-13(2,3)8-7-9-17/h15,17H,6-11H2,1-5H3,(H,16,18)
InChIKeyLREJCZNVQGRCOX-UHFFFAOYSA-N
MW258.41 g/mol
LogP1.68
Rot. Bonds9

About 2-[(5-hydroxy-2,2-dimethylpentyl)amino]-N-(2-methylbutan-2-yl)acetamide

2-[(5-hydroxy-2,2-dimethylpentyl)amino]-N-(2-methylbutan-2-yl)acetamide (PubChem CID 106147113) has the molecular formula C14H30N2O2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 2-[(5-hydroxy-2,2-dimethylpentyl)amino]-N-(2-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-[(5-hydroxy-2,2-dimethylpentyl)amino]-N-(2-methylbutan-2-yl)acetamide
PubChem CID106147113
Molecular FormulaC14H30N2O2
Molecular Weight258.41 g/mol
Exact Mass258.23
IUPAC Name2-[(5-hydroxy-2,2-dimethylpentyl)amino]-N-(2-methylbutan-2-yl)acetamide
SMILESCCC(C)(C)NC(=O)CNCC(C)(C)CCCO
InChIInChI=1S/C14H30N2O2/c1-6-14(4,5)16-12(18)10-15-11-13(2,3)8-7-9-17/h15,17H,6-11H2,1-5H3,(H,16,18)
InChIKeyLREJCZNVQGRCOX-UHFFFAOYSA-N
XLogP1.68
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 51.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-hydroxyethylamino)-N-(2-methylbutan-2-yl)acetamide
CID 60671300
2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-(2-methylbutan-2-yl)acetamide
CID 60672282
N-tert-butyl-2-[(4-hydroxy-2,2-dimethylbutyl)amino]acetamide
CID 106146940
4-hydroxy-N-(2-methylbutan-2-yl)butanamide
CID 79204830
5-(4-hydroxybutylamino)-4,4-dimethylpentan-1-ol
CID 106147208
2-(2,3-dihydroxypropylamino)-N-(2-methylbutan-2-yl)acetamide
CID 66168467
2-hydroxy-N-(2-methylbutan-2-yl)acetamide
CID 43558880
N-(2-methylbutan-2-yl)-2-[(2-methyl-2-phenylpropyl)amino]acetamide
CID 60976584
2-(cyclopropylmethylamino)-N-(5-hydroxy-2,2-dimethylpentyl)acetamide
CID 106148251
N-(2-methylbutan-2-yl)-2-(pent-4-ynylamino)acetamide
CID 106221318
2-(3-ethoxypropylamino)-N-(2-methylbutan-2-yl)acetamide
CID 60672261
2-amino-N-(5-hydroxy-2,2-dimethylpentyl)acetamide
CID 106148100

Frequently Asked Questions

What is the IUPAC name of 2-[(5-hydroxy-2,2-dimethylpentyl)amino]-N-(2-methylbutan-2-yl)acetamide?
The IUPAC name of 2-[(5-hydroxy-2,2-dimethylpentyl)amino]-N-(2-methylbutan-2-yl)acetamide (CID 106147113) is 2-[(5-hydroxy-2,2-dimethylpentyl)amino]-N-(2-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-[(5-hydroxy-2,2-dimethylpentyl)amino]-N-(2-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-[(5-hydroxy-2,2-dimethylpentyl)amino]-N-(2-methylbutan-2-yl)acetamide is CCC(C)(C)NC(=O)CNCC(C)(C)CCCO.
What is the InChIKey of 2-[(5-hydroxy-2,2-dimethylpentyl)amino]-N-(2-methylbutan-2-yl)acetamide?
The InChIKey is LREJCZNVQGRCOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2/c1-6-14(4,5)16-12(18)10-15-11-13(2,3)8-7-9-17/h15,17H,6-11H2,1-5H3,(H,16,18).
What are the key properties of 2-[(5-hydroxy-2,2-dimethylpentyl)amino]-N-(2-methylbutan-2-yl)acetamide?
2-[(5-hydroxy-2,2-dimethylpentyl)amino]-N-(2-methylbutan-2-yl)acetamide has a molecular weight of 258.41 g/mol, XLogP of 1.68, 9 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-hydroxy-2,2-dimethylpentyl)amino]-N-(2-methylbutan-2-yl)acetamide is sourced from PubChem (CID 106147113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).