N,2,2-trimethyl-N-prop-2-enylpropanamide

C9H17NO — CID 546192

IUPACN,2,2-trimethyl-N-prop-2-enylpropanamide
SMILESC=CCN(C)C(=O)C(C)(C)C
InChIInChI=1S/C9H17NO/c1-6-7-10(5)8(11)9(2,3)4/h6H,1,7H2,2-5H3
InChIKeySYINURAVUTZYHW-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.68
Rot. Bonds2

About N,2,2-trimethyl-N-prop-2-enylpropanamide

N,2,2-trimethyl-N-prop-2-enylpropanamide (PubChem CID 546192) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is N,2,2-trimethyl-N-prop-2-enylpropanamide.

Molecular Properties

Compound NameN,2,2-trimethyl-N-prop-2-enylpropanamide
PubChem CID546192
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC NameN,2,2-trimethyl-N-prop-2-enylpropanamide
SMILESC=CCN(C)C(=O)C(C)(C)C
InChIInChI=1S/C9H17NO/c1-6-7-10(5)8(11)9(2,3)4/h6H,1,7H2,2-5H3
InChIKeySYINURAVUTZYHW-UHFFFAOYSA-N
XLogP1.68
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-N-prop-2-enylpropanamide?
The IUPAC name of N,2,2-trimethyl-N-prop-2-enylpropanamide (CID 546192) is N,2,2-trimethyl-N-prop-2-enylpropanamide.
What is the SMILES notation for N,2,2-trimethyl-N-prop-2-enylpropanamide?
The canonical SMILES for N,2,2-trimethyl-N-prop-2-enylpropanamide is C=CCN(C)C(=O)C(C)(C)C.
What is the InChIKey of N,2,2-trimethyl-N-prop-2-enylpropanamide?
The InChIKey is SYINURAVUTZYHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-6-7-10(5)8(11)9(2,3)4/h6H,1,7H2,2-5H3.
What are the key properties of N,2,2-trimethyl-N-prop-2-enylpropanamide?
N,2,2-trimethyl-N-prop-2-enylpropanamide has a molecular weight of 155.24 g/mol, XLogP of 1.68, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-N-prop-2-enylpropanamide is sourced from PubChem (CID 546192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).