2-[acetyl(propan-2-yl)amino]-N-propylacetamide

C10H20N2O2 — CID 113158097

IUPAC2-[acetyl(propan-2-yl)amino]-N-propylacetamide
SMILESCCCNC(=O)CN(C(C)=O)C(C)C
InChIInChI=1S/C10H20N2O2/c1-5-6-11-10(14)7-12(8(2)3)9(4)13/h8H,5-7H2,1-4H3,(H,11,14)
InChIKeyKCJRDXGOSJGDBG-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.77
Rot. Bonds5

About 2-[acetyl(propan-2-yl)amino]-N-propylacetamide

2-[acetyl(propan-2-yl)amino]-N-propylacetamide (PubChem CID 113158097) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 2-[acetyl(propan-2-yl)amino]-N-propylacetamide.

Molecular Properties

Compound Name2-[acetyl(propan-2-yl)amino]-N-propylacetamide
PubChem CID113158097
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name2-[acetyl(propan-2-yl)amino]-N-propylacetamide
SMILESCCCNC(=O)CN(C(C)=O)C(C)C
InChIInChI=1S/C10H20N2O2/c1-5-6-11-10(14)7-12(8(2)3)9(4)13/h8H,5-7H2,1-4H3,(H,11,14)
InChIKeyKCJRDXGOSJGDBG-UHFFFAOYSA-N
XLogP0.77
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[acetyl(1-phenylethyl)amino]-N-propylacetamide
CID 113161938
methyl 2-[[2-[methyl-[2-oxo-2-(propylamino)ethyl]amino]-2-oxoethyl]-propan-2-ylamino]acetate
CID 62026833
3-[methyl(propan-2-yl)amino]-N-propylpropanamide
CID 170366588
2-[acetyl(propan-2-yl)amino]-N-benzylacetamide
CID 113158122
2-[2-hydroxyethyl(pentan-3-yl)amino]-N-propylacetamide
CID 62016057
2-[bis(2-hydroxyethyl)amino]-N-propylacetamide
CID 60686308
2-[acetyl-[3-(dimethylamino)propyl]amino]-N-propylacetamide
CID 113160764
3,4-dimethyl-N-propylpentanamide
CID 89425193
1-propan-2-yl-1-prop-2-enyl-3-propylurea
CID 115585837
2-(N-acetyl-4-propan-2-ylanilino)-N-propylacetamide
CID 113169744
2-[methyl-[2-oxo-2-(propylamino)ethyl]amino]pentanoic acid
CID 83041705
2-[2-[methyl(propan-2-yl)amino]ethylamino]-N-propylacetamide
CID 62642701

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(propan-2-yl)amino]-N-propylacetamide?
The IUPAC name of 2-[acetyl(propan-2-yl)amino]-N-propylacetamide (CID 113158097) is 2-[acetyl(propan-2-yl)amino]-N-propylacetamide.
What is the SMILES notation for 2-[acetyl(propan-2-yl)amino]-N-propylacetamide?
The canonical SMILES for 2-[acetyl(propan-2-yl)amino]-N-propylacetamide is CCCNC(=O)CN(C(C)=O)C(C)C.
What is the InChIKey of 2-[acetyl(propan-2-yl)amino]-N-propylacetamide?
The InChIKey is KCJRDXGOSJGDBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-5-6-11-10(14)7-12(8(2)3)9(4)13/h8H,5-7H2,1-4H3,(H,11,14).
What are the key properties of 2-[acetyl(propan-2-yl)amino]-N-propylacetamide?
2-[acetyl(propan-2-yl)amino]-N-propylacetamide has a molecular weight of 200.28 g/mol, XLogP of 0.77, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(propan-2-yl)amino]-N-propylacetamide is sourced from PubChem (CID 113158097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).