4-amino-N,4-dimethyl-N-pent-4-enylpentanamide

C12H24N2O — CID 115740355

IUPAC4-amino-N,4-dimethyl-N-pent-4-enylpentanamide
SMILESC=CCCCN(C)C(=O)CCC(C)(C)N
InChIInChI=1S/C12H24N2O/c1-5-6-7-10-14(4)11(15)8-9-12(2,3)13/h5H,1,6-10,13H2,2-4H3
InChIKeyDCSMQJMHDQCJBN-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.93
Rot. Bonds7

About 4-amino-N,4-dimethyl-N-pent-4-enylpentanamide

4-amino-N,4-dimethyl-N-pent-4-enylpentanamide (PubChem CID 115740355) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 4-amino-N,4-dimethyl-N-pent-4-enylpentanamide.

Molecular Properties

Compound Name4-amino-N,4-dimethyl-N-pent-4-enylpentanamide
PubChem CID115740355
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name4-amino-N,4-dimethyl-N-pent-4-enylpentanamide
SMILESC=CCCCN(C)C(=O)CCC(C)(C)N
InChIInChI=1S/C12H24N2O/c1-5-6-7-10-14(4)11(15)8-9-12(2,3)13/h5H,1,6-10,13H2,2-4H3
InChIKeyDCSMQJMHDQCJBN-UHFFFAOYSA-N
XLogP1.93
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-amino-N-(5-hydroxypentyl)-N,4-dimethylpentanamide
CID 107199292
N-methyl-N-pent-4-enylpropanamide
CID 115640317
N-methyl-N-pent-4-enyl-3-piperidin-4-ylpropanamide
CID 113343495
4-[methyl(undec-10-enoyl)amino]butanoic acid
CID 10016696
tert-butyl N-methyl-N-pent-4-enylcarbamate
CID 20756745
ethane;N-methyl-N-pent-4-enylacetamide
CID 143214157
3-(2-aminophenyl)-N-methyl-N-pent-4-enylpropanamide
CID 107273406
N-(3-amino-2,2-dimethylpropyl)-N-methylhex-5-enamide;dihydrochloride
CID 119656537
4-amino-N-(2-cyclohexylethyl)-N,4-dimethylpentanamide
CID 115157638
(2S)-3,3-dimethyl-2-[[2-[methyl(pent-4-enyl)amino]-2-oxoethyl]amino]butanoic acid
CID 149018278
2-hydroxyethyl-dimethyl-[2-[methyl(oct-7-enoyl)amino]ethyl]azanium
CID 101277775
N-methyl-2-(3-methylazetidin-3-yl)oxy-N-pent-4-enylacetamide
CID 102611697

Frequently Asked Questions

What is the IUPAC name of 4-amino-N,4-dimethyl-N-pent-4-enylpentanamide?
The IUPAC name of 4-amino-N,4-dimethyl-N-pent-4-enylpentanamide (CID 115740355) is 4-amino-N,4-dimethyl-N-pent-4-enylpentanamide.
What is the SMILES notation for 4-amino-N,4-dimethyl-N-pent-4-enylpentanamide?
The canonical SMILES for 4-amino-N,4-dimethyl-N-pent-4-enylpentanamide is C=CCCCN(C)C(=O)CCC(C)(C)N.
What is the InChIKey of 4-amino-N,4-dimethyl-N-pent-4-enylpentanamide?
The InChIKey is DCSMQJMHDQCJBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-5-6-7-10-14(4)11(15)8-9-12(2,3)13/h5H,1,6-10,13H2,2-4H3.
What are the key properties of 4-amino-N,4-dimethyl-N-pent-4-enylpentanamide?
4-amino-N,4-dimethyl-N-pent-4-enylpentanamide has a molecular weight of 212.34 g/mol, XLogP of 1.93, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N,4-dimethyl-N-pent-4-enylpentanamide is sourced from PubChem (CID 115740355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).