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

C12H26N2O2 — CID 60691833

IUPAC2-[2-hydroxyethyl(propyl)amino]-N-(3-methylbutan-2-yl)acetamide
SMILESCCCN(CCO)CC(=O)NC(C)C(C)C
InChIInChI=1S/C12H26N2O2/c1-5-6-14(7-8-15)9-12(16)13-11(4)10(2)3/h10-11,15H,5-9H2,1-4H3,(H,13,16)
InChIKeyCEHLYONRJANATF-UHFFFAOYSA-N
MW230.35 g/mol
LogP0.85
Rot. Bonds8

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

2-[2-hydroxyethyl(propyl)amino]-N-(3-methylbutan-2-yl)acetamide (PubChem CID 60691833) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 2-[2-hydroxyethyl(propyl)amino]-N-(3-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-[2-hydroxyethyl(propyl)amino]-N-(3-methylbutan-2-yl)acetamide
PubChem CID60691833
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name2-[2-hydroxyethyl(propyl)amino]-N-(3-methylbutan-2-yl)acetamide
SMILESCCCN(CCO)CC(=O)NC(C)C(C)C
InChIInChI=1S/C12H26N2O2/c1-5-6-14(7-8-15)9-12(16)13-11(4)10(2)3/h10-11,15H,5-9H2,1-4H3,(H,13,16)
InChIKeyCEHLYONRJANATF-UHFFFAOYSA-N
XLogP0.85
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
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-[ethyl(2-hydroxyethyl)amino]-N-(3-methylbutan-2-yl)acetamide
CID 60685750
N-butan-2-yl-2-[2-hydroxyethyl(propyl)amino]acetamide
CID 60691813
2-[butyl(2-hydroxyethyl)amino]-N-pentan-2-ylacetamide
CID 60689454
methyl (2S,3R)-2-[[2-[2-hydroxyethyl(propyl)amino]acetyl]amino]-3-methylpentanoate
CID 98762908
2-[2-hydroxyethyl(propan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide
CID 60691834
2-[butyl-[2-(3-methylbutan-2-ylamino)-2-oxoethyl]amino]acetamide
CID 51081968
2-[2-hydroxyethyl(propyl)amino]-N-(3-propan-2-yloxypropyl)acetamide
CID 60696638
2-hydroxy-N-[(2R)-3-methylbutan-2-yl]acetamide
CID 172508602
2-[butyl(2-hydroxyethyl)amino]-N-(2-hydroxyethyl)acetamide
CID 61446926
2-[bis(2-hydroxyethyl)amino]-N-propylacetamide
CID 60686308
2-[2-(dimethylamino)ethyl-[2-(3-methylbutan-2-ylamino)-2-oxoethyl]amino]acetic acid
CID 107425454
3-[ethyl-[2-(3-methylbutan-2-ylamino)-2-oxoethyl]amino]-2-methylpropanoic acid
CID 55122915

Frequently Asked Questions

What is the IUPAC name of 2-[2-hydroxyethyl(propyl)amino]-N-(3-methylbutan-2-yl)acetamide?
The IUPAC name of 2-[2-hydroxyethyl(propyl)amino]-N-(3-methylbutan-2-yl)acetamide (CID 60691833) is 2-[2-hydroxyethyl(propyl)amino]-N-(3-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-[2-hydroxyethyl(propyl)amino]-N-(3-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-[2-hydroxyethyl(propyl)amino]-N-(3-methylbutan-2-yl)acetamide is CCCN(CCO)CC(=O)NC(C)C(C)C.
What is the InChIKey of 2-[2-hydroxyethyl(propyl)amino]-N-(3-methylbutan-2-yl)acetamide?
The InChIKey is CEHLYONRJANATF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-5-6-14(7-8-15)9-12(16)13-11(4)10(2)3/h10-11,15H,5-9H2,1-4H3,(H,13,16).
What are the key properties of 2-[2-hydroxyethyl(propyl)amino]-N-(3-methylbutan-2-yl)acetamide?
2-[2-hydroxyethyl(propyl)amino]-N-(3-methylbutan-2-yl)acetamide has a molecular weight of 230.35 g/mol, XLogP of 0.85, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-hydroxyethyl(propyl)amino]-N-(3-methylbutan-2-yl)acetamide is sourced from PubChem (CID 60691833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).