N-tert-butyl-2-(1-hydroxypropan-2-ylamino)acetamide

C9H20N2O2 — CID 43499899

IUPACN-tert-butyl-2-(1-hydroxypropan-2-ylamino)acetamide
SMILESCC(CO)NCC(=O)NC(C)(C)C
InChIInChI=1S/C9H20N2O2/c1-7(6-12)10-5-8(13)11-9(2,3)4/h7,10,12H,5-6H2,1-4H3,(H,11,13)
InChIKeyZSKPPNNKKAMGEU-UHFFFAOYSA-N
MW188.27 g/mol
LogP-0.13
Rot. Bonds4

About N-tert-butyl-2-(1-hydroxypropan-2-ylamino)acetamide

N-tert-butyl-2-(1-hydroxypropan-2-ylamino)acetamide (PubChem CID 43499899) has the molecular formula C9H20N2O2 and a molecular weight of 188.27 g/mol. Its IUPAC name is N-tert-butyl-2-(1-hydroxypropan-2-ylamino)acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-(1-hydroxypropan-2-ylamino)acetamide
PubChem CID43499899
Molecular FormulaC9H20N2O2
Molecular Weight188.27 g/mol
Exact Mass188.15
IUPAC NameN-tert-butyl-2-(1-hydroxypropan-2-ylamino)acetamide
SMILESCC(CO)NCC(=O)NC(C)(C)C
InChIInChI=1S/C9H20N2O2/c1-7(6-12)10-5-8(13)11-9(2,3)4/h7,10,12H,5-6H2,1-4H3,(H,11,13)
InChIKeyZSKPPNNKKAMGEU-UHFFFAOYSA-N
XLogP-0.13
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 5-0.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-tert-butyl-2-[[(2R)-1-hydroxypropan-2-yl]amino]acetamide
CID 93083112
N-tert-butyl-2-(1-ethylsulfonylpropan-2-ylamino)acetamide
CID 113350703
N-tert-butyl-2-(3,3-dimethylbutan-2-ylamino)acetamide
CID 115627468
N-tert-butyl-2-(1-cyclobutylethylamino)acetamide
CID 115708515
N-tert-butyl-2-[5-(diethylamino)pentan-2-ylamino]acetamide
CID 43179840
N-tert-butyl-2-[[(1R)-1-cycloheptylethyl]amino]acetamide
CID 81393192
2-[1-(4-bromophenyl)propan-2-ylamino]-N-tert-butylacetamide
CID 103522146
2-[[2-(tert-butylamino)-2-oxoethyl]amino]-N-(2,2,2-trifluoroethyl)propanamide
CID 115574936
N-tert-butyl-2-[[2-(methylamino)-2-oxoethyl]amino]propanamide
CID 43214867
N-tert-butyl-2-[(1-methoxy-3-methylbutan-2-yl)amino]acetamide
CID 65048909
N-tert-butyl-2-[[(1S)-1-phenylethyl]amino]acetamide
CID 28564730
N-butan-2-yl-2-[[2-(tert-butylamino)-2-oxoethyl]amino]acetamide
CID 113219551

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(1-hydroxypropan-2-ylamino)acetamide?
The IUPAC name of N-tert-butyl-2-(1-hydroxypropan-2-ylamino)acetamide (CID 43499899) is N-tert-butyl-2-(1-hydroxypropan-2-ylamino)acetamide.
What is the SMILES notation for N-tert-butyl-2-(1-hydroxypropan-2-ylamino)acetamide?
The canonical SMILES for N-tert-butyl-2-(1-hydroxypropan-2-ylamino)acetamide is CC(CO)NCC(=O)NC(C)(C)C.
What is the InChIKey of N-tert-butyl-2-(1-hydroxypropan-2-ylamino)acetamide?
The InChIKey is ZSKPPNNKKAMGEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2/c1-7(6-12)10-5-8(13)11-9(2,3)4/h7,10,12H,5-6H2,1-4H3,(H,11,13).
What are the key properties of N-tert-butyl-2-(1-hydroxypropan-2-ylamino)acetamide?
N-tert-butyl-2-(1-hydroxypropan-2-ylamino)acetamide has a molecular weight of 188.27 g/mol, XLogP of -0.13, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(1-hydroxypropan-2-ylamino)acetamide is sourced from PubChem (CID 43499899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).