N,N,4,4-tetramethylpent-2-ynamide

C9H15NO — CID 13284840

IUPACN,N,4,4-tetramethylpent-2-ynamide
SMILESCN(C)C(=O)C#CC(C)(C)C
InChIInChI=1S/C9H15NO/c1-9(2,3)7-6-8(11)10(4)5/h1-5H3
InChIKeyYOHKEGBAAZKRIU-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.12
Rot. Bonds

About N,N,4,4-tetramethylpent-2-ynamide

N,N,4,4-tetramethylpent-2-ynamide (PubChem CID 13284840) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is N,N,4,4-tetramethylpent-2-ynamide.

Molecular Properties

Compound NameN,N,4,4-tetramethylpent-2-ynamide
PubChem CID13284840
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC NameN,N,4,4-tetramethylpent-2-ynamide
SMILESCN(C)C(=O)C#CC(C)(C)C
InChIInChI=1S/C9H15NO/c1-9(2,3)7-6-8(11)10(4)5/h1-5H3
InChIKeyYOHKEGBAAZKRIU-UHFFFAOYSA-N
XLogP1.12
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N,4,4-tetramethylpent-2-ynamide?
The IUPAC name of N,N,4,4-tetramethylpent-2-ynamide (CID 13284840) is N,N,4,4-tetramethylpent-2-ynamide.
What is the SMILES notation for N,N,4,4-tetramethylpent-2-ynamide?
The canonical SMILES for N,N,4,4-tetramethylpent-2-ynamide is CN(C)C(=O)C#CC(C)(C)C.
What is the InChIKey of N,N,4,4-tetramethylpent-2-ynamide?
The InChIKey is YOHKEGBAAZKRIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-9(2,3)7-6-8(11)10(4)5/h1-5H3.
What are the key properties of N,N,4,4-tetramethylpent-2-ynamide?
N,N,4,4-tetramethylpent-2-ynamide has a molecular weight of 153.22 g/mol, XLogP of 1.12, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,4,4-tetramethylpent-2-ynamide is sourced from PubChem (CID 13284840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).