2-(iminomethylideneamino)-3,3-dimethylpentan-2-amine

C8H17N3 — CID 87581329

IUPAC2-(iminomethylideneamino)-3,3-dimethylpentan-2-amine
SMILESCCC(C)(C)C(C)(N)N=C=N
InChIInChI=1S/C8H17N3/c1-5-7(2,3)8(4,10)11-6-9/h9H,5,10H2,1-4H3
InChIKeyHYRMVCFJBORQPD-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.85
Rot. Bonds3

About 2-(iminomethylideneamino)-3,3-dimethylpentan-2-amine

2-(iminomethylideneamino)-3,3-dimethylpentan-2-amine (PubChem CID 87581329) has the molecular formula C8H17N3 and a molecular weight of 155.24 g/mol. Its IUPAC name is 2-(iminomethylideneamino)-3,3-dimethylpentan-2-amine.

Molecular Properties

Compound Name2-(iminomethylideneamino)-3,3-dimethylpentan-2-amine
PubChem CID87581329
Molecular FormulaC8H17N3
Molecular Weight155.24 g/mol
Exact Mass155.14
IUPAC Name2-(iminomethylideneamino)-3,3-dimethylpentan-2-amine
SMILESCCC(C)(C)C(C)(N)N=C=N
InChIInChI=1S/C8H17N3/c1-5-7(2,3)8(4,10)11-6-9/h9H,5,10H2,1-4H3
InChIKeyHYRMVCFJBORQPD-UHFFFAOYSA-N
XLogP1.85
TPSA62.23 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(iminomethylideneamino)-3,3-dimethylpentan-2-amine?
The IUPAC name of 2-(iminomethylideneamino)-3,3-dimethylpentan-2-amine (CID 87581329) is 2-(iminomethylideneamino)-3,3-dimethylpentan-2-amine.
What is the SMILES notation for 2-(iminomethylideneamino)-3,3-dimethylpentan-2-amine?
The canonical SMILES for 2-(iminomethylideneamino)-3,3-dimethylpentan-2-amine is CCC(C)(C)C(C)(N)N=C=N.
What is the InChIKey of 2-(iminomethylideneamino)-3,3-dimethylpentan-2-amine?
The InChIKey is HYRMVCFJBORQPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3/c1-5-7(2,3)8(4,10)11-6-9/h9H,5,10H2,1-4H3.
What are the key properties of 2-(iminomethylideneamino)-3,3-dimethylpentan-2-amine?
2-(iminomethylideneamino)-3,3-dimethylpentan-2-amine has a molecular weight of 155.24 g/mol, XLogP of 1.85, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(iminomethylideneamino)-3,3-dimethylpentan-2-amine is sourced from PubChem (CID 87581329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).