2-amino-2-methyl-N-(3-methylpent-1-yn-3-yl)propanamide

C10H18N2O — CID 130756424

IUPAC2-amino-2-methyl-N-(3-methylpent-1-yn-3-yl)propanamide
SMILESC#CC(C)(CC)NC(=O)C(C)(C)N
InChIInChI=1S/C10H18N2O/c1-6-10(5,7-2)12-8(13)9(3,4)11/h1H,7,11H2,2-5H3,(H,12,13)
InChIKeyACZJOINKFBVYAL-UHFFFAOYSA-N
MW182.27 g/mol
LogP0.64
Rot. Bonds3

About 2-amino-2-methyl-N-(3-methylpent-1-yn-3-yl)propanamide

2-amino-2-methyl-N-(3-methylpent-1-yn-3-yl)propanamide (PubChem CID 130756424) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 2-amino-2-methyl-N-(3-methylpent-1-yn-3-yl)propanamide.

Molecular Properties

Compound Name2-amino-2-methyl-N-(3-methylpent-1-yn-3-yl)propanamide
PubChem CID130756424
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name2-amino-2-methyl-N-(3-methylpent-1-yn-3-yl)propanamide
SMILESC#CC(C)(CC)NC(=O)C(C)(C)N
InChIInChI=1S/C10H18N2O/c1-6-10(5,7-2)12-8(13)9(3,4)11/h1H,7,11H2,2-5H3,(H,12,13)
InChIKeyACZJOINKFBVYAL-UHFFFAOYSA-N
XLogP0.64
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

N-(1,1-Dimethylpropynyl)-propanamide
CID 549307
2-amino-3,3,3-trifluoro-2-methyl-N-(2-methylbut-3-yn-2-yl)propanamide
CID 79812240
N-(tert-Butyl)-2-(tert-butylamino)-2-methylpropanamide
CID 10910902
2-amino-N-tert-butyl-2-methylpropanamide
CID 27681105
N-tert-butylbut-3-ynamide
CID 57887415
2-amino-2-methyl-N-(2-methylbutan-2-yl)propanamide
CID 61264393
N-(3,4-dimethylpent-1-yn-3-yl)propanamide
CID 139811119
N-tert-butyl-2-[tert-butyl(but-3-ynyl)amino]-2-methylpropanamide
CID 142003659
2-amino-N-(3-ethylpent-1-yn-3-yl)acetamide
CID 143903158
N-(3-amino-2,3-dimethylbutan-2-yl)propanamide
CID 156761451
N-(2-methylbutan-2-yl)-2-(prop-2-ynylamino)propanamide
CID 43113303
2-Amino-N-(tert-butyl)-2-methylpropanamide hydrochloride
CID 56832043

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-N-(3-methylpent-1-yn-3-yl)propanamide?
The IUPAC name of 2-amino-2-methyl-N-(3-methylpent-1-yn-3-yl)propanamide (CID 130756424) is 2-amino-2-methyl-N-(3-methylpent-1-yn-3-yl)propanamide.
What is the SMILES notation for 2-amino-2-methyl-N-(3-methylpent-1-yn-3-yl)propanamide?
The canonical SMILES for 2-amino-2-methyl-N-(3-methylpent-1-yn-3-yl)propanamide is C#CC(C)(CC)NC(=O)C(C)(C)N.
What is the InChIKey of 2-amino-2-methyl-N-(3-methylpent-1-yn-3-yl)propanamide?
The InChIKey is ACZJOINKFBVYAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-6-10(5,7-2)12-8(13)9(3,4)11/h1H,7,11H2,2-5H3,(H,12,13).
What are the key properties of 2-amino-2-methyl-N-(3-methylpent-1-yn-3-yl)propanamide?
2-amino-2-methyl-N-(3-methylpent-1-yn-3-yl)propanamide has a molecular weight of 182.27 g/mol, XLogP of 0.64, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-N-(3-methylpent-1-yn-3-yl)propanamide is sourced from PubChem (CID 130756424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).