(2E,6E,10E)-2,6,10-trimethyl-14-oxo-N,N-dipropylpentadeca-2,6,10-trienamide

C24H41NO2 — CID 15069715

IUPAC(2E,6E,10E)-2,6,10-trimethyl-14-oxo-N,N-dipropylpentadeca-2,6,10-trienamide
SMILESCCCN(CCC)C(=O)/C(C)=C/CC/C(C)=C/CC/C(C)=C/CCC(C)=O
InChIInChI=1S/C24H41NO2/c1-7-18-25(19-8-2)24(27)22(5)16-10-14-20(3)12-9-13-21(4)15-11-17-23(6)26/h12,15-16H,7-11,13-14,17-19H2,1-6H3/b20-12+,21-15+,22-16+
InChIKeyRCYQHCUOCYGMTB-JTGSTRJLSA-N
MW375.60 g/mol
LogP6.40
Rot. Bonds14

About (2E,6E,10E)-2,6,10-trimethyl-14-oxo-N,N-dipropylpentadeca-2,6,10-trienamide

(2E,6E,10E)-2,6,10-trimethyl-14-oxo-N,N-dipropylpentadeca-2,6,10-trienamide (PubChem CID 15069715) has the molecular formula C24H41NO2 and a molecular weight of 375.60 g/mol. Its IUPAC name is (2E,6E,10E)-2,6,10-trimethyl-14-oxo-N,N-dipropylpentadeca-2,6,10-trienamide.

Molecular Properties

Compound Name(2E,6E,10E)-2,6,10-trimethyl-14-oxo-N,N-dipropylpentadeca-2,6,10-trienamide
PubChem CID15069715
Molecular FormulaC24H41NO2
Molecular Weight375.60 g/mol
Exact Mass375.31
IUPAC Name(2E,6E,10E)-2,6,10-trimethyl-14-oxo-N,N-dipropylpentadeca-2,6,10-trienamide
SMILESCCCN(CCC)C(=O)/C(C)=C/CC/C(C)=C/CC/C(C)=C/CCC(C)=O
InChIInChI=1S/C24H41NO2/c1-7-18-25(19-8-2)24(27)22(5)16-10-14-20(3)12-9-13-21(4)15-11-17-23(6)26/h12,15-16H,7-11,13-14,17-19H2,1-6H3/b20-12+,21-15+,22-16+
InChIKeyRCYQHCUOCYGMTB-JTGSTRJLSA-N
XLogP6.40
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds14
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.60
LogP ≤ 56.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze (2E,6E,10E)-2,6,10-trimethyl-14-oxo-N,N-dipropylpentadeca-2,6,10-trienamide with MolForge

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Launch Full Analysis

Related Compounds

1-[(2E)-3,7-dimethylocta-2,6-dienyl]-4,5-dimethyl-3H-pyridine-2,6-dione
CID 6377360
Ethylmaleamide, N,N,N',N'-tetraethyl-
CID 5374867
Butylmaleamide, N,N,N',N'-tetraethyl-
CID 5375940
(E)-N,N,5-triethyl-3,6-dioxooct-4-enamide
CID 11230533
(E)-N,N,2-triethylhept-2-enamide
CID 102303653
(2E,6E,10E,14E)-N,N,2,6,10,14-hexamethyl-18-oxononadeca-2,6,10,14-tetraenamide
CID 13646038
(2E,6E,10E,14E)-N,N-diethyl-2,6,10,14-tetramethyl-18-oxononadeca-2,6,10,14-tetraenamide
CID 13646039
(2E,6E,10E,14E)-2,6,10,14-tetramethyl-18-oxo-N,N-dipropylnonadeca-2,6,10,14-tetraenamide
CID 13646040
(2E,6E,10E,14E)-2,6,10,14-tetramethyl-18-oxo-N,N-di(propan-2-yl)nonadeca-2,6,10,14-tetraenamide
CID 13646041
(2E,6E,10E,14E)-N,N-dibutyl-2,6,10,14-tetramethyl-18-oxononadeca-2,6,10,14-tetraenamide
CID 13646042
(2E,6E,10E,14E)-2,6,10,14-tetramethyl-N,N-bis(2-methylpropyl)-18-oxononadeca-2,6,10,14-tetraenamide
CID 13646043
(E)-N,N-diethyl-2-methylpent-2-enamide
CID 14773864

Frequently Asked Questions

What is the IUPAC name of (2E,6E,10E)-2,6,10-trimethyl-14-oxo-N,N-dipropylpentadeca-2,6,10-trienamide?
The IUPAC name of (2E,6E,10E)-2,6,10-trimethyl-14-oxo-N,N-dipropylpentadeca-2,6,10-trienamide (CID 15069715) is (2E,6E,10E)-2,6,10-trimethyl-14-oxo-N,N-dipropylpentadeca-2,6,10-trienamide.
What is the SMILES notation for (2E,6E,10E)-2,6,10-trimethyl-14-oxo-N,N-dipropylpentadeca-2,6,10-trienamide?
The canonical SMILES for (2E,6E,10E)-2,6,10-trimethyl-14-oxo-N,N-dipropylpentadeca-2,6,10-trienamide is CCCN(CCC)C(=O)/C(C)=C/CC/C(C)=C/CC/C(C)=C/CCC(C)=O.
What is the InChIKey of (2E,6E,10E)-2,6,10-trimethyl-14-oxo-N,N-dipropylpentadeca-2,6,10-trienamide?
The InChIKey is RCYQHCUOCYGMTB-JTGSTRJLSA-N. The full InChI is InChI=1S/C24H41NO2/c1-7-18-25(19-8-2)24(27)22(5)16-10-14-20(3)12-9-13-21(4)15-11-17-23(6)26/h12,15-16H,7-11,13-14,17-19H2,1-6H3/b20-12+,21-15+,22-16+.
What are the key properties of (2E,6E,10E)-2,6,10-trimethyl-14-oxo-N,N-dipropylpentadeca-2,6,10-trienamide?
(2E,6E,10E)-2,6,10-trimethyl-14-oxo-N,N-dipropylpentadeca-2,6,10-trienamide has a molecular weight of 375.60 g/mol, XLogP of 6.40, 14 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,6E,10E)-2,6,10-trimethyl-14-oxo-N,N-dipropylpentadeca-2,6,10-trienamide is sourced from PubChem (CID 15069715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).