N,N,3,3-tetramethylpent-4-enamide

C9H17NO — CID 13020109

IUPACN,N,3,3-tetramethylpent-4-enamide
SMILESC=CC(C)(C)CC(=O)N(C)C
InChIInChI=1S/C9H17NO/c1-6-9(2,3)7-8(11)10(4)5/h6H,1,7H2,2-5H3
InChIKeyMBUAAACGRUHOFP-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.68
Rot. Bonds3

About N,N,3,3-tetramethylpent-4-enamide

N,N,3,3-tetramethylpent-4-enamide (PubChem CID 13020109) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is N,N,3,3-tetramethylpent-4-enamide.

Molecular Properties

Compound NameN,N,3,3-tetramethylpent-4-enamide
PubChem CID13020109
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC NameN,N,3,3-tetramethylpent-4-enamide
SMILESC=CC(C)(C)CC(=O)N(C)C
InChIInChI=1S/C9H17NO/c1-6-9(2,3)7-8(11)10(4)5/h6H,1,7H2,2-5H3
InChIKeyMBUAAACGRUHOFP-UHFFFAOYSA-N
XLogP1.68
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
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'}

Analyze N,N,3,3-tetramethylpent-4-enamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,3-difluoro-N,N-dimethylbutanamide
CID 130667654
N,N,3-trimethyl-3-sulfanylbutanamide
CID 90216913
N,N,3,3-tetramethylpentanamide
CID 23394541
(3R)-3,5-dihydroxy-N,N,3-trimethylpentanamide
CID 87266925
N,N-dimethylpent-4-enamide
CID 13308678
3,3-dimethyl-1-phenylpent-4-en-1-one
CID 14397690
2-methylpropyl 3,3-dimethylpent-4-enoate
CID 71371395
ethyl 4-(dimethylamino)-2-hydroxy-2-methyl-4-oxobutanoate
CID 87491131
N-butyl-3,3-dimethylpent-4-enamide
CID 154977240
4,5-dichloro-N,N,3,3-tetramethylpentanamide
CID 170564857
N,N,3-trimethylpent-4-enamide
CID 10654310
tert-butyl 2-amino-4-(dimethylamino)-2-methyl-4-oxobutanoate
CID 175133888

Frequently Asked Questions

What is the IUPAC name of N,N,3,3-tetramethylpent-4-enamide?
The IUPAC name of N,N,3,3-tetramethylpent-4-enamide (CID 13020109) is N,N,3,3-tetramethylpent-4-enamide.
What is the SMILES notation for N,N,3,3-tetramethylpent-4-enamide?
The canonical SMILES for N,N,3,3-tetramethylpent-4-enamide is C=CC(C)(C)CC(=O)N(C)C.
What is the InChIKey of N,N,3,3-tetramethylpent-4-enamide?
The InChIKey is MBUAAACGRUHOFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-6-9(2,3)7-8(11)10(4)5/h6H,1,7H2,2-5H3.
What are the key properties of N,N,3,3-tetramethylpent-4-enamide?
N,N,3,3-tetramethylpent-4-enamide has a molecular weight of 155.24 g/mol, XLogP of 1.68, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,3,3-tetramethylpent-4-enamide is sourced from PubChem (CID 13020109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).