CID 140756261

C23H47N2O — CID 140756261

IUPAC—
SMILES[CH2]N(C)CCCNC(=O)CCCCCCCCCCCCCCCCC
InChIInChI=1S/C23H47N2O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23(26)24-21-19-22-25(2)3/h2,4-22H2,1,3H3,(H,24,26)
InChIKeyZABHABSALIMTGR-UHFFFAOYSA-N
MW367.64 g/mol
LogP6.48
Rot. Bonds20

About CID 140756261

CID 140756261 (PubChem CID 140756261) has the molecular formula C23H47N2O and a molecular weight of 367.64 g/mol.

Molecular Properties

Compound NameCID 140756261
PubChem CID140756261
Molecular FormulaC23H47N2O
Molecular Weight367.64 g/mol
Exact Mass367.37
IUPAC Name—
SMILES[CH2]N(C)CCCNC(=O)CCCCCCCCCCCCCCCCC
InChIInChI=1S/C23H47N2O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23(26)24-21-19-22-25(2)3/h2,4-22H2,1,3H3,(H,24,26)
InChIKeyZABHABSALIMTGR-UHFFFAOYSA-N
XLogP6.48
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds20
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500367.64
LogP ≤ 56.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(dimethylamino)propyl]nonanamide
CID 3395805
N-[3-(dimethylamino)propyl]octadecanamide;hydrochloride
CID 3019212
N-[3-[3-[bis[3-(tetradecanoylamino)propyl]amino]propyl-[3-(tetradecanoylamino)propyl]amino]propyl]tetradecanamide
CID 88929141
N-[3-[2-hydroxyethyl(methyl)amino]propyl]pentadecanamide
CID 102462917
N-nonyltridecanamide
CID 154228217
N-[3-(triacontanoylamino)propyl]triacontanamide
CID 89373214
N-[6-(pentadecanoylamino)hexyl]pentadecanamide
CID 102117556
N-dodecylhexanamide
CID 3362981
N,N'-dihexadecyldecanediamide
CID 17080069
N-[8-(dodecanoylamino)octyl]dodecanamide
CID 3273664
N-tetradecyloctanamide
CID 151737522
N-[6-(tricosanoylamino)hexyl]tricosanamide
CID 102117558

Frequently Asked Questions

What is the IUPAC name of CID 140756261?
The IUPAC name of CID 140756261 (CID 140756261) is not available.
What is the SMILES notation for CID 140756261?
The canonical SMILES for CID 140756261 is [CH2]N(C)CCCNC(=O)CCCCCCCCCCCCCCCCC.
What is the InChIKey of CID 140756261?
The InChIKey is ZABHABSALIMTGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H47N2O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-23(26)24-21-19-22-25(2)3/h2,4-22H2,1,3H3,(H,24,26).
What are the key properties of CID 140756261?
CID 140756261 has a molecular weight of 367.64 g/mol, XLogP of 6.48, 20 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 140756261 is sourced from PubChem (CID 140756261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).