N-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide

C10H20N2 — CID 54233080

IUPACN-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide
SMILESC=C/C(=N\C(C)C)N(C)C(C)C
InChIInChI=1S/C10H20N2/c1-7-10(11-8(2)3)12(6)9(4)5/h7-9H,1H2,2-6H3/b11-10+
InChIKeyQKPXOUBPYHMDTQ-ZHACJKMWSA-N
MW168.28 g/mol
LogP2.32
Rot. Bonds3

About N-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide

N-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide (PubChem CID 54233080) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is N-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide.

Molecular Properties

Compound NameN-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide
PubChem CID54233080
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC NameN-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide
SMILESC=C/C(=N\C(C)C)N(C)C(C)C
InChIInChI=1S/C10H20N2/c1-7-10(11-8(2)3)12(6)9(4)5/h7-9H,1H2,2-6H3/b11-10+
InChIKeyQKPXOUBPYHMDTQ-ZHACJKMWSA-N
XLogP2.32
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide?
The IUPAC name of N-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide (CID 54233080) is N-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide.
What is the SMILES notation for N-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide?
The canonical SMILES for N-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide is C=C/C(=N\C(C)C)N(C)C(C)C.
What is the InChIKey of N-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide?
The InChIKey is QKPXOUBPYHMDTQ-ZHACJKMWSA-N. The full InChI is InChI=1S/C10H20N2/c1-7-10(11-8(2)3)12(6)9(4)5/h7-9H,1H2,2-6H3/b11-10+.
What are the key properties of N-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide?
N-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide has a molecular weight of 168.28 g/mol, XLogP of 2.32, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide is sourced from PubChem (CID 54233080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).