N,2-dimethyl-N-tetracosylprop-2-enamide

C29H57NO — CID 87262023

IUPACN,2-dimethyl-N-tetracosylprop-2-enamide
SMILESC=C(C)C(=O)N(C)CCCCCCCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C29H57NO/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-30(4)29(31)28(2)3/h2,5-27H2,1,3-4H3
InChIKeyYDWUNXPZTISXGJ-UHFFFAOYSA-N
MW435.78 g/mol
LogP9.62
Rot. Bonds24

About N,2-dimethyl-N-tetracosylprop-2-enamide

N,2-dimethyl-N-tetracosylprop-2-enamide (PubChem CID 87262023) has the molecular formula C29H57NO and a molecular weight of 435.78 g/mol. Its IUPAC name is N,2-dimethyl-N-tetracosylprop-2-enamide.

Molecular Properties

Compound NameN,2-dimethyl-N-tetracosylprop-2-enamide
PubChem CID87262023
Molecular FormulaC29H57NO
Molecular Weight435.78 g/mol
Exact Mass435.44
IUPAC NameN,2-dimethyl-N-tetracosylprop-2-enamide
SMILESC=C(C)C(=O)N(C)CCCCCCCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C29H57NO/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-30(4)29(31)28(2)3/h2,5-27H2,1,3-4H3
InChIKeyYDWUNXPZTISXGJ-UHFFFAOYSA-N
XLogP9.62
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds24
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500435.78
LogP ≤ 59.62
H-Bond Donors ≤ 50
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

N-butyl-2-methyl-N-octylprop-2-enamide
CID 20743986
N-decyl-N-methylacetamide
CID 22114742
2-methyl-N-pentylprop-2-enehydrazide
CID 87197020
N-butyl-2-methyl-N-pentylprop-2-enamide
CID 87098831
ethane;N-methyl-N-octylacetamide
CID 142531459
N,2-dimethyl-N-[3-[4-(4-pentylphenyl)phenyl]propyl]prop-2-enamide
CID 134246359
hexadecyl(methyl)carbamic acid
CID 15173799
N-(3-butyl-3-trimethylsilylheptyl)-N,2-dimethylprop-2-enamide
CID 59819360
N-(methoxymethyl)-2-methyl-N-octylprop-2-enamide
CID 139967484
N-hexyl-N-methylcarbamoyl chloride
CID 23509235
N-butyl-N-methyl-2-oxopropanamide;ethane
CID 142836775
N',N'-dibutyl-N,2-dimethylprop-2-enehydrazide
CID 87504496

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-tetracosylprop-2-enamide?
The IUPAC name of N,2-dimethyl-N-tetracosylprop-2-enamide (CID 87262023) is N,2-dimethyl-N-tetracosylprop-2-enamide.
What is the SMILES notation for N,2-dimethyl-N-tetracosylprop-2-enamide?
The canonical SMILES for N,2-dimethyl-N-tetracosylprop-2-enamide is C=C(C)C(=O)N(C)CCCCCCCCCCCCCCCCCCCCCCCC.
What is the InChIKey of N,2-dimethyl-N-tetracosylprop-2-enamide?
The InChIKey is YDWUNXPZTISXGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H57NO/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-30(4)29(31)28(2)3/h2,5-27H2,1,3-4H3.
What are the key properties of N,2-dimethyl-N-tetracosylprop-2-enamide?
N,2-dimethyl-N-tetracosylprop-2-enamide has a molecular weight of 435.78 g/mol, XLogP of 9.62, 24 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-tetracosylprop-2-enamide is sourced from PubChem (CID 87262023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).