N',N'-diphenyldodecanediamide

C24H32N2O2 — CID 70400318

IUPACN',N'-diphenyldodecanediamide
SMILESNC(=O)CCCCCCCCCCC(=O)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H32N2O2/c25-23(27)19-13-5-3-1-2-4-6-14-20-24(28)26(21-15-9-7-10-16-21)22-17-11-8-12-18-22/h7-12,15-18H,1-6,13-14,19-20H2,(H2,25,27)
InChIKeyWLMJPDWXSHAENQ-UHFFFAOYSA-N
MW380.53 g/mol
LogP5.74
Rot. Bonds13

About N',N'-diphenyldodecanediamide

N',N'-diphenyldodecanediamide (PubChem CID 70400318) has the molecular formula C24H32N2O2 and a molecular weight of 380.53 g/mol. Its IUPAC name is N',N'-diphenyldodecanediamide.

Molecular Properties

Compound NameN',N'-diphenyldodecanediamide
PubChem CID70400318
Molecular FormulaC24H32N2O2
Molecular Weight380.53 g/mol
Exact Mass380.25
IUPAC NameN',N'-diphenyldodecanediamide
SMILESNC(=O)CCCCCCCCCCC(=O)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H32N2O2/c25-23(27)19-13-5-3-1-2-4-6-14-20-24(28)26(21-15-9-7-10-16-21)22-17-11-8-12-18-22/h7-12,15-18H,1-6,13-14,19-20H2,(H2,25,27)
InChIKeyWLMJPDWXSHAENQ-UHFFFAOYSA-N
XLogP5.74
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.53
LogP ≤ 55.74
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',N'-bis(2-aminophenyl)heptanediamide
CID 66893972
7-amino-N-(3-amino-3-oxopropyl)-N-phenylheptanamide
CID 119696693
3-chloro-N,N-diphenylpropanamide
CID 3331408
N,N'-bis(3-amino-3-oxopropyl)-N,N'-dibenzylhexanediamide
CID 28642999
4-oxo-N,N,4-triphenylbutanamide
CID 11695603
1,1-diphenylurea
CID 174849888
hexanediamide;naphthalene
CID 175366237
4-amino-N-(3-amino-3-oxopropyl)-N-phenylbutanamide;hydrochloride
CID 119275169
N',N'-bis(4-cyanophenyl)pentanediamide
CID 68500230
3-hydroxy-N-(4-hydroxyphenyl)-N-phenylpropanamide
CID 134339234
N-ethyl-N-methyl-N',N'-diphenylbutanediamide
CID 172997394
N-fluoro-8-oxo-N-phenylnonanamide
CID 174449894

Frequently Asked Questions

What is the IUPAC name of N',N'-diphenyldodecanediamide?
The IUPAC name of N',N'-diphenyldodecanediamide (CID 70400318) is N',N'-diphenyldodecanediamide.
What is the SMILES notation for N',N'-diphenyldodecanediamide?
The canonical SMILES for N',N'-diphenyldodecanediamide is NC(=O)CCCCCCCCCCC(=O)N(c1ccccc1)c1ccccc1.
What is the InChIKey of N',N'-diphenyldodecanediamide?
The InChIKey is WLMJPDWXSHAENQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N2O2/c25-23(27)19-13-5-3-1-2-4-6-14-20-24(28)26(21-15-9-7-10-16-21)22-17-11-8-12-18-22/h7-12,15-18H,1-6,13-14,19-20H2,(H2,25,27).
What are the key properties of N',N'-diphenyldodecanediamide?
N',N'-diphenyldodecanediamide has a molecular weight of 380.53 g/mol, XLogP of 5.74, 13 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-diphenyldodecanediamide is sourced from PubChem (CID 70400318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).