2-[2-hydroxyethyl(propan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide

C12H26N2O2 — CID 60691834

IUPAC2-[2-hydroxyethyl(propan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide
SMILESCC(C)C(C)NC(=O)CN(CCO)C(C)C
InChIInChI=1S/C12H26N2O2/c1-9(2)11(5)13-12(16)8-14(6-7-15)10(3)4/h9-11,15H,6-8H2,1-5H3,(H,13,16)
InChIKeyFGTYWROWZIRSQW-UHFFFAOYSA-N
MW230.35 g/mol
LogP0.85
Rot. Bonds7

About 2-[2-hydroxyethyl(propan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide

2-[2-hydroxyethyl(propan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide (PubChem CID 60691834) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 2-[2-hydroxyethyl(propan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-[2-hydroxyethyl(propan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide
PubChem CID60691834
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name2-[2-hydroxyethyl(propan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide
SMILESCC(C)C(C)NC(=O)CN(CCO)C(C)C
InChIInChI=1S/C12H26N2O2/c1-9(2)11(5)13-12(16)8-14(6-7-15)10(3)4/h9-11,15H,6-8H2,1-5H3,(H,13,16)
InChIKeyFGTYWROWZIRSQW-UHFFFAOYSA-N
XLogP0.85
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-aminoethyl(propan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide
CID 61489563
2-[3-aminopropyl(propan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide
CID 54962103
2-[ethyl(2-hydroxyethyl)amino]-N-(3-methylbutan-2-yl)acetamide
CID 60685750
2-[2-hydroxyethyl(propyl)amino]-N-(3-methylbutan-2-yl)acetamide
CID 60691833
2-[3-hydroxypropyl(propan-2-yl)amino]-N-(2-methyl-4-oxopentan-3-yl)acetamide
CID 62014229
N-(ethylcarbamoyl)-2-[2-hydroxyethyl(propan-2-yl)amino]acetamide
CID 60691915
2-[2-hydroxyethyl(propan-2-yl)amino]-N-prop-2-enylacetamide
CID 60691703
2-[ethyl-[2-[2-hydroxyethyl(propan-2-yl)amino]acetyl]amino]-N-propan-2-ylacetamide
CID 60696906
2-[2-hydroxyethyl(propan-2-yl)amino]-N-[1-(2-methylphenyl)ethyl]acetamide
CID 60692471
2-[2-hydroxyethyl(pentan-3-yl)amino]-N-pentan-2-ylacetamide
CID 62016068
2-hydroxy-N-[(2R)-3-methylbutan-2-yl]acetamide
CID 172508602
N-(3-methylbutan-2-yl)-2-[piperidin-4-ylmethyl(propan-2-yl)amino]acetamide
CID 79714649

Frequently Asked Questions

What is the IUPAC name of 2-[2-hydroxyethyl(propan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide?
The IUPAC name of 2-[2-hydroxyethyl(propan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide (CID 60691834) is 2-[2-hydroxyethyl(propan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-[2-hydroxyethyl(propan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-[2-hydroxyethyl(propan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide is CC(C)C(C)NC(=O)CN(CCO)C(C)C.
What is the InChIKey of 2-[2-hydroxyethyl(propan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide?
The InChIKey is FGTYWROWZIRSQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-9(2)11(5)13-12(16)8-14(6-7-15)10(3)4/h9-11,15H,6-8H2,1-5H3,(H,13,16).
What are the key properties of 2-[2-hydroxyethyl(propan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide?
2-[2-hydroxyethyl(propan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide has a molecular weight of 230.35 g/mol, XLogP of 0.85, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-hydroxyethyl(propan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide is sourced from PubChem (CID 60691834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).