N,N-dimethyl-N'-propan-2-ylmethanimidamide

C6H14N2 — CID 525286

IUPACN,N-dimethyl-N'-propan-2-ylmethanimidamide
SMILESCC(C)/N=C/N(C)C
InChIInChI=1S/C6H14N2/c1-6(2)7-5-8(3)4/h5-6H,1-4H3/b7-5+
InChIKeyNCHYGMRFKDUUAI-FNORWQNLSA-N
MW114.19 g/mol
LogP0.98
Rot. Bonds2

About N,N-dimethyl-N'-propan-2-ylmethanimidamide

N,N-dimethyl-N'-propan-2-ylmethanimidamide (PubChem CID 525286) has the molecular formula C6H14N2 and a molecular weight of 114.19 g/mol. Its IUPAC name is N,N-dimethyl-N'-propan-2-ylmethanimidamide.

Molecular Properties

Compound NameN,N-dimethyl-N'-propan-2-ylmethanimidamide
PubChem CID525286
Molecular FormulaC6H14N2
Molecular Weight114.19 g/mol
Exact Mass114.12
IUPAC NameN,N-dimethyl-N'-propan-2-ylmethanimidamide
SMILESCC(C)/N=C/N(C)C
InChIInChI=1S/C6H14N2/c1-6(2)7-5-8(3)4/h5-6H,1-4H3/b7-5+
InChIKeyNCHYGMRFKDUUAI-FNORWQNLSA-N
XLogP0.98
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.19
LogP ≤ 50.98
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,N-dimethyl-N'-propan-2-ylmethanimidamide 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,N-dimethyl-N'-propan-2-ylmethanimidamide?
The IUPAC name of N,N-dimethyl-N'-propan-2-ylmethanimidamide (CID 525286) is N,N-dimethyl-N'-propan-2-ylmethanimidamide.
What is the SMILES notation for N,N-dimethyl-N'-propan-2-ylmethanimidamide?
The canonical SMILES for N,N-dimethyl-N'-propan-2-ylmethanimidamide is CC(C)/N=C/N(C)C.
What is the InChIKey of N,N-dimethyl-N'-propan-2-ylmethanimidamide?
The InChIKey is NCHYGMRFKDUUAI-FNORWQNLSA-N. The full InChI is InChI=1S/C6H14N2/c1-6(2)7-5-8(3)4/h5-6H,1-4H3/b7-5+.
What are the key properties of N,N-dimethyl-N'-propan-2-ylmethanimidamide?
N,N-dimethyl-N'-propan-2-ylmethanimidamide has a molecular weight of 114.19 g/mol, XLogP of 0.98, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-N'-propan-2-ylmethanimidamide is sourced from PubChem (CID 525286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).