N,2,3-trimethyl-4-methyliminopentan-2-amine

C9H20N2 — CID 54210143

IUPACN,2,3-trimethyl-4-methyliminopentan-2-amine
SMILESC/N=C(\C)C(C)C(C)(C)NC
InChIInChI=1S/C9H20N2/c1-7(8(2)10-5)9(3,4)11-6/h7,11H,1-6H3/b10-8+
InChIKeyPVJNGKBOMOYZLX-CSKARUKUSA-N
MW156.27 g/mol
LogP1.71
Rot. Bonds3

About N,2,3-trimethyl-4-methyliminopentan-2-amine

N,2,3-trimethyl-4-methyliminopentan-2-amine (PubChem CID 54210143) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is N,2,3-trimethyl-4-methyliminopentan-2-amine.

Molecular Properties

Compound NameN,2,3-trimethyl-4-methyliminopentan-2-amine
PubChem CID54210143
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC NameN,2,3-trimethyl-4-methyliminopentan-2-amine
SMILESC/N=C(\C)C(C)C(C)(C)NC
InChIInChI=1S/C9H20N2/c1-7(8(2)10-5)9(3,4)11-6/h7,11H,1-6H3/b10-8+
InChIKeyPVJNGKBOMOYZLX-CSKARUKUSA-N
XLogP1.71
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 N,2,3-trimethyl-4-methyliminopentan-2-amine?
The IUPAC name of N,2,3-trimethyl-4-methyliminopentan-2-amine (CID 54210143) is N,2,3-trimethyl-4-methyliminopentan-2-amine.
What is the SMILES notation for N,2,3-trimethyl-4-methyliminopentan-2-amine?
The canonical SMILES for N,2,3-trimethyl-4-methyliminopentan-2-amine is C/N=C(\C)C(C)C(C)(C)NC.
What is the InChIKey of N,2,3-trimethyl-4-methyliminopentan-2-amine?
The InChIKey is PVJNGKBOMOYZLX-CSKARUKUSA-N. The full InChI is InChI=1S/C9H20N2/c1-7(8(2)10-5)9(3,4)11-6/h7,11H,1-6H3/b10-8+.
What are the key properties of N,2,3-trimethyl-4-methyliminopentan-2-amine?
N,2,3-trimethyl-4-methyliminopentan-2-amine has a molecular weight of 156.27 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,3-trimethyl-4-methyliminopentan-2-amine is sourced from PubChem (CID 54210143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).