2-methylundec-2-enimidamide

C12H24N2 — CID 159441486

IUPAC2-methylundec-2-enimidamide
SMILES[H]/N=C(\N)C(C)=CCCCCCCCC
InChIInChI=1S/C12H24N2/c1-3-4-5-6-7-8-9-10-11(2)12(13)14/h10H,3-9H2,1-2H3,(H3,13,14)
InChIKeyLSFQAYGHZZLOOZ-UHFFFAOYSA-N
MW196.34 g/mol
LogP3.62
Rot. Bonds8

About 2-methylundec-2-enimidamide

2-methylundec-2-enimidamide (PubChem CID 159441486) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 2-methylundec-2-enimidamide.

Molecular Properties

Compound Name2-methylundec-2-enimidamide
PubChem CID159441486
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name2-methylundec-2-enimidamide
SMILES[H]/N=C(\N)C(C)=CCCCCCCCC
InChIInChI=1S/C12H24N2/c1-3-4-5-6-7-8-9-10-11(2)12(13)14/h10H,3-9H2,1-2H3,(H3,13,14)
InChIKeyLSFQAYGHZZLOOZ-UHFFFAOYSA-N
XLogP3.62
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 53.62
H-Bond Donors ≤ 52
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 2-methylundec-2-enimidamide?
The IUPAC name of 2-methylundec-2-enimidamide (CID 159441486) is 2-methylundec-2-enimidamide.
What is the SMILES notation for 2-methylundec-2-enimidamide?
The canonical SMILES for 2-methylundec-2-enimidamide is [H]/N=C(\N)C(C)=CCCCCCCCC.
What is the InChIKey of 2-methylundec-2-enimidamide?
The InChIKey is LSFQAYGHZZLOOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-3-4-5-6-7-8-9-10-11(2)12(13)14/h10H,3-9H2,1-2H3,(H3,13,14).
What are the key properties of 2-methylundec-2-enimidamide?
2-methylundec-2-enimidamide has a molecular weight of 196.34 g/mol, XLogP of 3.62, 8 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylundec-2-enimidamide is sourced from PubChem (CID 159441486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).