2-[2-aminoethyl(propan-2-yl)amino]acetamide

C7H17N3O — CID 61348378

IUPAC2-[2-aminoethyl(propan-2-yl)amino]acetamide
SMILESCC(C)N(CCN)CC(N)=O
InChIInChI=1S/C7H17N3O/c1-6(2)10(4-3-8)5-7(9)11/h6H,3-5,8H2,1-2H3,(H2,9,11)
InChIKeyOOBMYFXMESNJKU-UHFFFAOYSA-N
MW159.23 g/mol
LogP-0.86
Rot. Bonds5

About 2-[2-aminoethyl(propan-2-yl)amino]acetamide

2-[2-aminoethyl(propan-2-yl)amino]acetamide (PubChem CID 61348378) has the molecular formula C7H17N3O and a molecular weight of 159.23 g/mol. Its IUPAC name is 2-[2-aminoethyl(propan-2-yl)amino]acetamide.

Molecular Properties

Compound Name2-[2-aminoethyl(propan-2-yl)amino]acetamide
PubChem CID61348378
Molecular FormulaC7H17N3O
Molecular Weight159.23 g/mol
Exact Mass159.14
IUPAC Name2-[2-aminoethyl(propan-2-yl)amino]acetamide
SMILESCC(C)N(CCN)CC(N)=O
InChIInChI=1S/C7H17N3O/c1-6(2)10(4-3-8)5-7(9)11/h6H,3-5,8H2,1-2H3,(H2,9,11)
InChIKeyOOBMYFXMESNJKU-UHFFFAOYSA-N
XLogP-0.86
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 5-0.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[propan-2-yl(3-sulfanylbutyl)amino]acetamide
CID 170206201
3-[(2-amino-2-oxoethyl)-propan-2-ylamino]-N-(3-aminopropyl)-N-methylpropanamide
CID 54988932
2-[ethyl(propan-2-yl)amino]acetamide
CID 22371770
1-[3-aminopropyl(propan-2-yl)amino]propan-2-one
CID 89029623
2-[(6-amino-5,5-dimethylhexyl)-propan-2-ylamino]acetamide
CID 106708016
2-[2-aminoethyl(propan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide
CID 61489563
2-[2-aminoethyl(propan-2-yl)amino]-N-cyclopropyl-N-ethylacetamide
CID 61488181
1-[propan-2-yl(propyl)amino]propan-2-one
CID 43795396
2-[2-aminoethyl(propan-2-yl)amino]-1-(4-methylpiperazin-1-yl)ethanone
CID 61348571
2-[2-aminoethyl(propan-2-yl)amino]-N-(2-methylbutan-2-yl)acetamide
CID 61486484
potassium [(2-amino-2-oxoethyl)-propan-2-ylamino]methyl-trifluoroboranuide
CID 63703594
N-(3-aminopropyl)-N-methyl-2-[propan-2-yl(propyl)amino]acetamide
CID 43269272

Frequently Asked Questions

What is the IUPAC name of 2-[2-aminoethyl(propan-2-yl)amino]acetamide?
The IUPAC name of 2-[2-aminoethyl(propan-2-yl)amino]acetamide (CID 61348378) is 2-[2-aminoethyl(propan-2-yl)amino]acetamide.
What is the SMILES notation for 2-[2-aminoethyl(propan-2-yl)amino]acetamide?
The canonical SMILES for 2-[2-aminoethyl(propan-2-yl)amino]acetamide is CC(C)N(CCN)CC(N)=O.
What is the InChIKey of 2-[2-aminoethyl(propan-2-yl)amino]acetamide?
The InChIKey is OOBMYFXMESNJKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3O/c1-6(2)10(4-3-8)5-7(9)11/h6H,3-5,8H2,1-2H3,(H2,9,11).
What are the key properties of 2-[2-aminoethyl(propan-2-yl)amino]acetamide?
2-[2-aminoethyl(propan-2-yl)amino]acetamide has a molecular weight of 159.23 g/mol, XLogP of -0.86, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-aminoethyl(propan-2-yl)amino]acetamide is sourced from PubChem (CID 61348378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).