(E)-N-methyl-11-phenylundec-2-enamide

C18H27NO — CID 118028584

IUPAC(E)-N-methyl-11-phenylundec-2-enamide
SMILESCNC(=O)/C=C/CCCCCCCCc1ccccc1
InChIInChI=1S/C18H27NO/c1-19-18(20)16-12-7-5-3-2-4-6-9-13-17-14-10-8-11-15-17/h8,10-12,14-16H,2-7,9,13H2,1H3,(H,19,20)/b16-12+
InChIKeyNKIRLJVLPAKUPV-FOWTUZBSSA-N
MW273.42 g/mol
LogP4.26
Rot. Bonds10

About (E)-N-methyl-11-phenylundec-2-enamide

(E)-N-methyl-11-phenylundec-2-enamide (PubChem CID 118028584) has the molecular formula C18H27NO and a molecular weight of 273.42 g/mol. Its IUPAC name is (E)-N-methyl-11-phenylundec-2-enamide.

Molecular Properties

Compound Name(E)-N-methyl-11-phenylundec-2-enamide
PubChem CID118028584
Molecular FormulaC18H27NO
Molecular Weight273.42 g/mol
Exact Mass273.21
IUPAC Name(E)-N-methyl-11-phenylundec-2-enamide
SMILESCNC(=O)/C=C/CCCCCCCCc1ccccc1
InChIInChI=1S/C18H27NO/c1-19-18(20)16-12-7-5-3-2-4-6-9-13-17-14-10-8-11-15-17/h8,10-12,14-16H,2-7,9,13H2,1H3,(H,19,20)/b16-12+
InChIKeyNKIRLJVLPAKUPV-FOWTUZBSSA-N
XLogP4.26
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(E)-N-methyl-5-phenylpent-2-enamide
CID 11321418
9-phenylnon-2-enamide
CID 123957146
N-(8-phenyloct-2-enyl)acetamide
CID 123336500
ethyl (E)-9-phenylnon-2-enoate
CID 10753852
N-methyl-9-phenylnonanamide
CID 118028570
(E)-7-phenyl-1-pyrrol-1-ylhept-2-en-1-one
CID 102332503
N-(4-tetradecylphenyl)undec-2-enamide
CID 167433428
N-(4-octylphenyl)undec-2-enamide
CID 167433429
N,N-dimethyl-10-phenyldeca-2,4-dienamide
CID 123909046
11-phenylundec-1-ene-1-sulfonic acid
CID 54264801
N-(2-methylpropyl)-9-phenylnona-2,4-dienamide
CID 90802349
(E)-1-(4-methoxyphenyl)-9-phenylnon-2-en-1-one
CID 10734633

Frequently Asked Questions

What is the IUPAC name of (E)-N-methyl-11-phenylundec-2-enamide?
The IUPAC name of (E)-N-methyl-11-phenylundec-2-enamide (CID 118028584) is (E)-N-methyl-11-phenylundec-2-enamide.
What is the SMILES notation for (E)-N-methyl-11-phenylundec-2-enamide?
The canonical SMILES for (E)-N-methyl-11-phenylundec-2-enamide is CNC(=O)/C=C/CCCCCCCCc1ccccc1.
What is the InChIKey of (E)-N-methyl-11-phenylundec-2-enamide?
The InChIKey is NKIRLJVLPAKUPV-FOWTUZBSSA-N. The full InChI is InChI=1S/C18H27NO/c1-19-18(20)16-12-7-5-3-2-4-6-9-13-17-14-10-8-11-15-17/h8,10-12,14-16H,2-7,9,13H2,1H3,(H,19,20)/b16-12+.
What are the key properties of (E)-N-methyl-11-phenylundec-2-enamide?
(E)-N-methyl-11-phenylundec-2-enamide has a molecular weight of 273.42 g/mol, XLogP of 4.26, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-methyl-11-phenylundec-2-enamide is sourced from PubChem (CID 118028584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).