N-butan-2-yl-2-[butyl(2-hydroxyethyl)amino]propanamide

C13H28N2O2 — CID 62016390

IUPACN-butan-2-yl-2-[butyl(2-hydroxyethyl)amino]propanamide
SMILESCCCCN(CCO)C(C)C(=O)NC(C)CC
InChIInChI=1S/C13H28N2O2/c1-5-7-8-15(9-10-16)12(4)13(17)14-11(3)6-2/h11-12,16H,5-10H2,1-4H3,(H,14,17)
InChIKeyBWDLEWCSXHLGTO-UHFFFAOYSA-N
MW244.38 g/mol
LogP1.38
Rot. Bonds9

About N-butan-2-yl-2-[butyl(2-hydroxyethyl)amino]propanamide

N-butan-2-yl-2-[butyl(2-hydroxyethyl)amino]propanamide (PubChem CID 62016390) has the molecular formula C13H28N2O2 and a molecular weight of 244.38 g/mol. Its IUPAC name is N-butan-2-yl-2-[butyl(2-hydroxyethyl)amino]propanamide.

Molecular Properties

Compound NameN-butan-2-yl-2-[butyl(2-hydroxyethyl)amino]propanamide
PubChem CID62016390
Molecular FormulaC13H28N2O2
Molecular Weight244.38 g/mol
Exact Mass244.22
IUPAC NameN-butan-2-yl-2-[butyl(2-hydroxyethyl)amino]propanamide
SMILESCCCCN(CCO)C(C)C(=O)NC(C)CC
InChIInChI=1S/C13H28N2O2/c1-5-7-8-15(9-10-16)12(4)13(17)14-11(3)6-2/h11-12,16H,5-10H2,1-4H3,(H,14,17)
InChIKeyBWDLEWCSXHLGTO-UHFFFAOYSA-N
XLogP1.38
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
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

N-butan-2-yl-2-[ethyl(3-hydroxypropyl)amino]propanamide
CID 115869014
2-[2-hydroxyethyl(propyl)amino]-N-pentan-2-ylpropanamide
CID 62014640
2-[butyl(2-hydroxyethyl)amino]-N-pentylpropanamide
CID 62016391
2-[2-hydroxyethyl(propyl)amino]-N-pentan-3-ylpropanamide
CID 62014639
2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-pentan-2-ylpropanamide
CID 107485178
2-[ethyl(2-hydroxyethyl)amino]-N-pentan-3-ylpropanamide
CID 62020833
3-[[1-(butan-2-ylamino)-1-oxopropan-2-yl]-ethylamino]propanoic acid
CID 61010078
2-[3-aminopropyl(propyl)amino]-N-pentan-2-ylpropanamide
CID 43137331
2-[butyl(2-hydroxyethyl)amino]-3-methylbutanehydrazide
CID 63585073
2-[2-hydroxyethyl(methyl)amino]-N-pentan-2-ylpropanamide
CID 62020256
2-[cyclopropyl(2-hydroxyethyl)amino]-N-pentan-2-ylpropanamide
CID 62021160
N-cyclopropyl-2-[2-hydroxyethyl(propyl)amino]propanamide
CID 60691805

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-[butyl(2-hydroxyethyl)amino]propanamide?
The IUPAC name of N-butan-2-yl-2-[butyl(2-hydroxyethyl)amino]propanamide (CID 62016390) is N-butan-2-yl-2-[butyl(2-hydroxyethyl)amino]propanamide.
What is the SMILES notation for N-butan-2-yl-2-[butyl(2-hydroxyethyl)amino]propanamide?
The canonical SMILES for N-butan-2-yl-2-[butyl(2-hydroxyethyl)amino]propanamide is CCCCN(CCO)C(C)C(=O)NC(C)CC.
What is the InChIKey of N-butan-2-yl-2-[butyl(2-hydroxyethyl)amino]propanamide?
The InChIKey is BWDLEWCSXHLGTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O2/c1-5-7-8-15(9-10-16)12(4)13(17)14-11(3)6-2/h11-12,16H,5-10H2,1-4H3,(H,14,17).
What are the key properties of N-butan-2-yl-2-[butyl(2-hydroxyethyl)amino]propanamide?
N-butan-2-yl-2-[butyl(2-hydroxyethyl)amino]propanamide has a molecular weight of 244.38 g/mol, XLogP of 1.38, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-[butyl(2-hydroxyethyl)amino]propanamide is sourced from PubChem (CID 62016390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).