3-amino-N-(2,2-dimethylbutyl)-2-hydroxypropanamide

C9H20N2O2 — CID 115180877

IUPAC3-amino-N-(2,2-dimethylbutyl)-2-hydroxypropanamide
SMILESCCC(C)(C)CNC(=O)C(O)CN
InChIInChI=1S/C9H20N2O2/c1-4-9(2,3)6-11-8(13)7(12)5-10/h7,12H,4-6,10H2,1-3H3,(H,11,13)
InChIKeyLAHMPWYZRJLYMN-UHFFFAOYSA-N
MW188.27 g/mol
LogP-0.14
Rot. Bonds5

About 3-amino-N-(2,2-dimethylbutyl)-2-hydroxypropanamide

3-amino-N-(2,2-dimethylbutyl)-2-hydroxypropanamide (PubChem CID 115180877) has the molecular formula C9H20N2O2 and a molecular weight of 188.27 g/mol. Its IUPAC name is 3-amino-N-(2,2-dimethylbutyl)-2-hydroxypropanamide.

Molecular Properties

Compound Name3-amino-N-(2,2-dimethylbutyl)-2-hydroxypropanamide
PubChem CID115180877
Molecular FormulaC9H20N2O2
Molecular Weight188.27 g/mol
Exact Mass188.15
IUPAC Name3-amino-N-(2,2-dimethylbutyl)-2-hydroxypropanamide
SMILESCCC(C)(C)CNC(=O)C(O)CN
InChIInChI=1S/C9H20N2O2/c1-4-9(2,3)6-11-8(13)7(12)5-10/h7,12H,4-6,10H2,1-3H3,(H,11,13)
InChIKeyLAHMPWYZRJLYMN-UHFFFAOYSA-N
XLogP-0.14
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 5-0.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(2,2-dimethylbutyl)butanamide
CID 103461499
2-amino-N-(2,2-dimethylbutyl)-4-methylpentanamide
CID 103461635
3-(aminomethyl)-N-(2,2-dimethylbutyl)pentanamide
CID 103461469
2-amino-N-(2,2-dimethylbutyl)hexanamide
CID 103461638
2-carbamothioyl-N-(2,2-dimethylbutyl)-3-methylbutanamide
CID 103461803
(2R)-2-amino-N-(2,2-dimethylbutyl)-4-methylsulfanylbutanamide
CID 103461634
N-(2-aminoethyl)-N'-(2,2-dimethylbutyl)oxamide
CID 103460009
2-amino-N-(2,2-dimethylbutyl)-2-ethylbutanamide
CID 103461588
N-(3-amino-2,2-dimethylpropyl)-2-propylpentanamide
CID 82987576
(2R)-3-amino-2-hydroxy-N-methylpropanamide
CID 55284383
N-(3-amino-2,2-dimethylpropyl)-2,3-dimethylbutanamide
CID 115365699
3-amino-N-(2,2-dimethylbutyl)-2,2,3-trimethylbutanamide
CID 103461615

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2,2-dimethylbutyl)-2-hydroxypropanamide?
The IUPAC name of 3-amino-N-(2,2-dimethylbutyl)-2-hydroxypropanamide (CID 115180877) is 3-amino-N-(2,2-dimethylbutyl)-2-hydroxypropanamide.
What is the SMILES notation for 3-amino-N-(2,2-dimethylbutyl)-2-hydroxypropanamide?
The canonical SMILES for 3-amino-N-(2,2-dimethylbutyl)-2-hydroxypropanamide is CCC(C)(C)CNC(=O)C(O)CN.
What is the InChIKey of 3-amino-N-(2,2-dimethylbutyl)-2-hydroxypropanamide?
The InChIKey is LAHMPWYZRJLYMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2/c1-4-9(2,3)6-11-8(13)7(12)5-10/h7,12H,4-6,10H2,1-3H3,(H,11,13).
What are the key properties of 3-amino-N-(2,2-dimethylbutyl)-2-hydroxypropanamide?
3-amino-N-(2,2-dimethylbutyl)-2-hydroxypropanamide has a molecular weight of 188.27 g/mol, XLogP of -0.14, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2,2-dimethylbutyl)-2-hydroxypropanamide is sourced from PubChem (CID 115180877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).