N,N-dimethyl-N'-nonylpropanimidamide

C14H30N2 — CID 525842

IUPACN,N-dimethyl-N'-nonylpropanimidamide
SMILESCCCCCCCCC/N=C(\CC)N(C)C
InChIInChI=1S/C14H30N2/c1-5-7-8-9-10-11-12-13-15-14(6-2)16(3)4/h5-13H2,1-4H3/b15-14+
InChIKeyKOVLPGYCOAGVEZ-CCEZHUSRSA-N
MW226.41 g/mol
LogP4.11
Rot. Bonds9

About N,N-dimethyl-N'-nonylpropanimidamide

N,N-dimethyl-N'-nonylpropanimidamide (PubChem CID 525842) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is N,N-dimethyl-N'-nonylpropanimidamide.

Molecular Properties

Compound NameN,N-dimethyl-N'-nonylpropanimidamide
PubChem CID525842
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC NameN,N-dimethyl-N'-nonylpropanimidamide
SMILESCCCCCCCCC/N=C(\CC)N(C)C
InChIInChI=1S/C14H30N2/c1-5-7-8-9-10-11-12-13-15-14(6-2)16(3)4/h5-13H2,1-4H3/b15-14+
InChIKeyKOVLPGYCOAGVEZ-CCEZHUSRSA-N
XLogP4.11
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 54.11
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-dimethyl-N'-nonylpropanimidamide?
The IUPAC name of N,N-dimethyl-N'-nonylpropanimidamide (CID 525842) is N,N-dimethyl-N'-nonylpropanimidamide.
What is the SMILES notation for N,N-dimethyl-N'-nonylpropanimidamide?
The canonical SMILES for N,N-dimethyl-N'-nonylpropanimidamide is CCCCCCCCC/N=C(\CC)N(C)C.
What is the InChIKey of N,N-dimethyl-N'-nonylpropanimidamide?
The InChIKey is KOVLPGYCOAGVEZ-CCEZHUSRSA-N. The full InChI is InChI=1S/C14H30N2/c1-5-7-8-9-10-11-12-13-15-14(6-2)16(3)4/h5-13H2,1-4H3/b15-14+.
What are the key properties of N,N-dimethyl-N'-nonylpropanimidamide?
N,N-dimethyl-N'-nonylpropanimidamide has a molecular weight of 226.41 g/mol, XLogP of 4.11, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-N'-nonylpropanimidamide is sourced from PubChem (CID 525842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).