N,N,2-trimethyl-N'-nonylpropanimidamide

C15H32N2 — CID 525906

IUPACN,N,2-trimethyl-N'-nonylpropanimidamide
SMILESCCCCCCCCC/N=C(\C(C)C)N(C)C
InChIInChI=1S/C15H32N2/c1-6-7-8-9-10-11-12-13-16-15(14(2)3)17(4)5/h14H,6-13H2,1-5H3/b16-15+
InChIKeyRZFZHKKCFUQDES-FOCLMDBBSA-N
MW240.43 g/mol
LogP4.35
Rot. Bonds9

About N,N,2-trimethyl-N'-nonylpropanimidamide

N,N,2-trimethyl-N'-nonylpropanimidamide (PubChem CID 525906) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is N,N,2-trimethyl-N'-nonylpropanimidamide.

Molecular Properties

Compound NameN,N,2-trimethyl-N'-nonylpropanimidamide
PubChem CID525906
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC NameN,N,2-trimethyl-N'-nonylpropanimidamide
SMILESCCCCCCCCC/N=C(\C(C)C)N(C)C
InChIInChI=1S/C15H32N2/c1-6-7-8-9-10-11-12-13-16-15(14(2)3)17(4)5/h14H,6-13H2,1-5H3/b16-15+
InChIKeyRZFZHKKCFUQDES-FOCLMDBBSA-N
XLogP4.35
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N,2-trimethyl-N'-nonylpropanimidamide?
The IUPAC name of N,N,2-trimethyl-N'-nonylpropanimidamide (CID 525906) is N,N,2-trimethyl-N'-nonylpropanimidamide.
What is the SMILES notation for N,N,2-trimethyl-N'-nonylpropanimidamide?
The canonical SMILES for N,N,2-trimethyl-N'-nonylpropanimidamide is CCCCCCCCC/N=C(\C(C)C)N(C)C.
What is the InChIKey of N,N,2-trimethyl-N'-nonylpropanimidamide?
The InChIKey is RZFZHKKCFUQDES-FOCLMDBBSA-N. The full InChI is InChI=1S/C15H32N2/c1-6-7-8-9-10-11-12-13-16-15(14(2)3)17(4)5/h14H,6-13H2,1-5H3/b16-15+.
What are the key properties of N,N,2-trimethyl-N'-nonylpropanimidamide?
N,N,2-trimethyl-N'-nonylpropanimidamide has a molecular weight of 240.43 g/mol, XLogP of 4.35, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2-trimethyl-N'-nonylpropanimidamide is sourced from PubChem (CID 525906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).