2-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dipropylacetamide

C12H26N2O2 — CID 115772259

IUPAC2-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)CN(C)C(C)CO
InChIInChI=1S/C12H26N2O2/c1-5-7-14(8-6-2)12(16)9-13(4)11(3)10-15/h11,15H,5-10H2,1-4H3
InChIKeyLDTQGVNJBOPMLQ-UHFFFAOYSA-N
MW230.35 g/mol
LogP0.95
Rot. Bonds8

About 2-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dipropylacetamide

2-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dipropylacetamide (PubChem CID 115772259) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 2-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dipropylacetamide.

Molecular Properties

Compound Name2-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dipropylacetamide
PubChem CID115772259
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name2-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)CN(C)C(C)CO
InChIInChI=1S/C12H26N2O2/c1-5-7-14(8-6-2)12(16)9-13(4)11(3)10-15/h11,15H,5-10H2,1-4H3
InChIKeyLDTQGVNJBOPMLQ-UHFFFAOYSA-N
XLogP0.95
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-hydroxypropan-2-yl(methyl)amino]-N-methyl-N-propan-2-ylacetamide
CID 104554051
2-[2-hydroxypropyl(methyl)amino]-N,N-dipropylacetamide
CID 62334661
3-[[2-(dipropylamino)-2-oxoethyl]-propylamino]-2-methylpropanoic acid
CID 82327114
2-[methyl(2-methylprop-2-enyl)amino]propan-1-ol
CID 115772235
2-(3-hydroxy-2-methylpropyl)sulfanyl-N,N-dipropylacetamide
CID 66103337
2-[bis[2-(dipropylamino)-2-oxoethyl]amino]acetic acid
CID 138501380
3-amino-N,N-dipropylbutanamide
CID 60836307
ethyl 3-[1-hydroxypropan-2-yl(methyl)amino]-2-methylpropanoate
CID 104552494
1-[1-hydroxypropan-2-yl(methyl)amino]-3-methoxypropan-2-one
CID 107507543
methyl 2-[[2-(dipropylamino)-2-oxoethyl]-propan-2-ylamino]acetate
CID 62027203
N-butan-2-yl-2-[1-hydroxypropan-2-yl(methyl)amino]acetamide
CID 115877326
2-[4-aminobutan-2-yl(methyl)amino]-N,N-diethylacetamide
CID 61453369

Frequently Asked Questions

What is the IUPAC name of 2-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dipropylacetamide?
The IUPAC name of 2-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dipropylacetamide (CID 115772259) is 2-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dipropylacetamide.
What is the SMILES notation for 2-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dipropylacetamide?
The canonical SMILES for 2-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dipropylacetamide is CCCN(CCC)C(=O)CN(C)C(C)CO.
What is the InChIKey of 2-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dipropylacetamide?
The InChIKey is LDTQGVNJBOPMLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-5-7-14(8-6-2)12(16)9-13(4)11(3)10-15/h11,15H,5-10H2,1-4H3.
What are the key properties of 2-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dipropylacetamide?
2-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dipropylacetamide has a molecular weight of 230.35 g/mol, XLogP of 0.95, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dipropylacetamide is sourced from PubChem (CID 115772259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).