N-[3-(tritylamino)propyl]prop-2-enamide

C25H26N2O — CID 139888249

IUPACN-[3-(tritylamino)propyl]prop-2-enamide
SMILESC=CC(=O)NCCCNC(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H26N2O/c1-2-24(28)26-19-12-20-27-25(21-13-6-3-7-14-21,22-15-8-4-9-16-22)23-17-10-5-11-18-23/h2-11,13-18,27H,1,12,19-20H2,(H,26,28)
InChIKeyRXXCPICGPMDMKM-UHFFFAOYSA-N
MW370.50 g/mol
LogP4.26
Rot. Bonds9

About N-[3-(tritylamino)propyl]prop-2-enamide

N-[3-(tritylamino)propyl]prop-2-enamide (PubChem CID 139888249) has the molecular formula C25H26N2O and a molecular weight of 370.50 g/mol. Its IUPAC name is N-[3-(tritylamino)propyl]prop-2-enamide.

Molecular Properties

Compound NameN-[3-(tritylamino)propyl]prop-2-enamide
PubChem CID139888249
Molecular FormulaC25H26N2O
Molecular Weight370.50 g/mol
Exact Mass370.20
IUPAC NameN-[3-(tritylamino)propyl]prop-2-enamide
SMILESC=CC(=O)NCCCNC(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H26N2O/c1-2-24(28)26-19-12-20-27-25(21-13-6-3-7-14-21,22-15-8-4-9-16-22)23-17-10-5-11-18-23/h2-11,13-18,27H,1,12,19-20H2,(H,26,28)
InChIKeyRXXCPICGPMDMKM-UHFFFAOYSA-N
XLogP4.26
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.50
LogP ≤ 54.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[4-(prop-2-enoylamino)butyl]prop-2-enamide
CID 11542941
N-[12-(prop-2-enoylamino)dodecyl]prop-2-enamide;N-[9-(prop-2-enoylamino)nonyl]prop-2-enamide
CID 159527537
N-[3-(2-methylbut-3-en-2-ylamino)propyl]-3-phenylprop-2-enamide
CID 87903078
N'-trityl-N-[4-[7-(tritylamino)heptylamino]butyl]heptane-1,7-diamine
CID 101358103
acetic acid;N'-tritylethane-1,2-diamine
CID 43835039
6-(tritylamino)hexylazanium acetate
CID 171034868
N-[(3R)-3-hydroxy-3-phenylpropyl]prop-2-enamide
CID 166414439
N-[3-[(2,2,2-trifluoroacetyl)amino]propyl]prop-2-enamide
CID 18970234
N-[dihydroxy(phenyl)methyl]prop-2-enamide
CID 155683465
N-[2-(tritylamino)ethyl]formamide
CID 11002043
N-(3-hydroxypropyl)prop-2-enamide
CID 87194577
methanol;N-(2-phenylethyl)prop-2-enamide;prop-2-enamide
CID 175300118

Frequently Asked Questions

What is the IUPAC name of N-[3-(tritylamino)propyl]prop-2-enamide?
The IUPAC name of N-[3-(tritylamino)propyl]prop-2-enamide (CID 139888249) is N-[3-(tritylamino)propyl]prop-2-enamide.
What is the SMILES notation for N-[3-(tritylamino)propyl]prop-2-enamide?
The canonical SMILES for N-[3-(tritylamino)propyl]prop-2-enamide is C=CC(=O)NCCCNC(c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[3-(tritylamino)propyl]prop-2-enamide?
The InChIKey is RXXCPICGPMDMKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O/c1-2-24(28)26-19-12-20-27-25(21-13-6-3-7-14-21,22-15-8-4-9-16-22)23-17-10-5-11-18-23/h2-11,13-18,27H,1,12,19-20H2,(H,26,28).
What are the key properties of N-[3-(tritylamino)propyl]prop-2-enamide?
N-[3-(tritylamino)propyl]prop-2-enamide has a molecular weight of 370.50 g/mol, XLogP of 4.26, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(tritylamino)propyl]prop-2-enamide is sourced from PubChem (CID 139888249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).