2-[ethyl(3-hydroxypropyl)amino]-N-(2-methylbutan-2-yl)propanamide

C13H28N2O2 — CID 113342816

IUPAC2-[ethyl(3-hydroxypropyl)amino]-N-(2-methylbutan-2-yl)propanamide
SMILESCCN(CCCO)C(C)C(=O)NC(C)(C)CC
InChIInChI=1S/C13H28N2O2/c1-6-13(4,5)14-12(17)11(3)15(7-2)9-8-10-16/h11,16H,6-10H2,1-5H3,(H,14,17)
InChIKeyGUAIXKDCURORRB-UHFFFAOYSA-N
MW244.38 g/mol
LogP1.38
Rot. Bonds8

About 2-[ethyl(3-hydroxypropyl)amino]-N-(2-methylbutan-2-yl)propanamide

2-[ethyl(3-hydroxypropyl)amino]-N-(2-methylbutan-2-yl)propanamide (PubChem CID 113342816) has the molecular formula C13H28N2O2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 2-[ethyl(3-hydroxypropyl)amino]-N-(2-methylbutan-2-yl)propanamide.

Molecular Properties

Compound Name2-[ethyl(3-hydroxypropyl)amino]-N-(2-methylbutan-2-yl)propanamide
PubChem CID113342816
Molecular FormulaC13H28N2O2
Molecular Weight244.38 g/mol
Exact Mass244.22
IUPAC Name2-[ethyl(3-hydroxypropyl)amino]-N-(2-methylbutan-2-yl)propanamide
SMILESCCN(CCCO)C(C)C(=O)NC(C)(C)CC
InChIInChI=1S/C13H28N2O2/c1-6-13(4,5)14-12(17)11(3)15(7-2)9-8-10-16/h11,16H,6-10H2,1-5H3,(H,14,17)
InChIKeyGUAIXKDCURORRB-UHFFFAOYSA-N
XLogP1.38
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-aminoethyl(ethyl)amino]-N-(2-methylbutan-2-yl)propanamide
CID 61350485
3-[ethyl-[1-(2-methylbutan-2-ylamino)-1-oxopropan-2-yl]amino]-2-methylpropanoic acid
CID 62851344
N-butan-2-yl-2-[ethyl(3-hydroxypropyl)amino]propanamide
CID 115869014
2-[2-aminoethyl(propyl)amino]-N-(2-methylbutan-2-yl)propanamide
CID 61350121
2-(diethylamino)-N-(2,4,4-trimethylpentan-2-yl)propanamide
CID 3031109
2-(3-hydroxypropylamino)-N-(2-methylbutan-2-yl)propanamide
CID 43416442
2-[2-aminoethyl(methyl)amino]-N-(2-methylbutan-2-yl)propanamide
CID 61349502
2-[(2-amino-2-oxoethyl)-[1-(2-methylbutan-2-ylamino)-1-oxopropan-2-yl]amino]acetic acid
CID 107440476
2-[bis(2-hydroxyethyl)amino]-N-tert-butylpropanamide
CID 60686797
2-[2-aminoethyl(propan-2-yl)amino]-N-(2-methylbutan-2-yl)propanamide
CID 61350303
3-[methyl-[1-(2-methylbutan-2-ylamino)-1-oxopropan-2-yl]amino]propanoic acid;hydrochloride
CID 119911897
2-[5-aminopentyl(methyl)amino]-N-(2-methylbutan-2-yl)propanamide
CID 107207248

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(3-hydroxypropyl)amino]-N-(2-methylbutan-2-yl)propanamide?
The IUPAC name of 2-[ethyl(3-hydroxypropyl)amino]-N-(2-methylbutan-2-yl)propanamide (CID 113342816) is 2-[ethyl(3-hydroxypropyl)amino]-N-(2-methylbutan-2-yl)propanamide.
What is the SMILES notation for 2-[ethyl(3-hydroxypropyl)amino]-N-(2-methylbutan-2-yl)propanamide?
The canonical SMILES for 2-[ethyl(3-hydroxypropyl)amino]-N-(2-methylbutan-2-yl)propanamide is CCN(CCCO)C(C)C(=O)NC(C)(C)CC.
What is the InChIKey of 2-[ethyl(3-hydroxypropyl)amino]-N-(2-methylbutan-2-yl)propanamide?
The InChIKey is GUAIXKDCURORRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O2/c1-6-13(4,5)14-12(17)11(3)15(7-2)9-8-10-16/h11,16H,6-10H2,1-5H3,(H,14,17).
What are the key properties of 2-[ethyl(3-hydroxypropyl)amino]-N-(2-methylbutan-2-yl)propanamide?
2-[ethyl(3-hydroxypropyl)amino]-N-(2-methylbutan-2-yl)propanamide has a molecular weight of 244.38 g/mol, XLogP of 1.38, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(3-hydroxypropyl)amino]-N-(2-methylbutan-2-yl)propanamide is sourced from PubChem (CID 113342816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).