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

C10H20N2 — CID 88832844

IUPAC2-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide
SMILESC=C(C)/C(=N\C(C)C)NC(C)C
InChIInChI=1S/C10H20N2/c1-7(2)10(11-8(3)4)12-9(5)6/h8-9H,1H2,2-6H3,(H,11,12)
InChIKeyZPQJIRNBBIEEKV-UHFFFAOYSA-N
MW168.28 g/mol
LogP2.37
Rot. Bonds3

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

2-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide (PubChem CID 88832844) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 2-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide.

Molecular Properties

Compound Name2-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide
PubChem CID88832844
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name2-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide
SMILESC=C(C)/C(=N\C(C)C)NC(C)C
InChIInChI=1S/C10H20N2/c1-7(2)10(11-8(3)4)12-9(5)6/h8-9H,1H2,2-6H3,(H,11,12)
InChIKeyZPQJIRNBBIEEKV-UHFFFAOYSA-N
XLogP2.37
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N'-tert-butyl-2-methyl-N,N-di(propan-2-yl)prop-2-enimidamide
CID 330670
2-prop-1-en-2-yl-4,5-dihydro-1H-imidazole
CID 19746927
6-Ethyl-2-prop-1-en-2-yl-1,4,5,6-tetrahydropyrimidine
CID 22756056
N-propan-2-yl-N'-prop-2-enyl-3-(prop-2-enylamino)propanimidamide
CID 88113944
(E)-N-butan-2-yl-N',2-dimethylbut-2-enimidamide
CID 118972865
(Z)-3-amino-N-ethyl-N',2-dimethylprop-2-enimidamide
CID 118972951
(Z)-3-amino-N-ethyl-N',2-dimethyl-N-propylprop-2-enimidamide
CID 118973186
(E)-N-ethyl-N',2-dimethylbut-2-enimidamide
CID 118973189
N',2-dimethyl-N-propylprop-2-enimidamide
CID 118973463
(E)-N-tert-butyl-N',2-dimethylbut-2-enimidamide
CID 123271328
N'-methyl-N-(2-methylbut-2-enyl)propanimidamide
CID 123564371
3-methyl-N-propan-2-yl-N'-propylbut-2-enimidamide
CID 130433854

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide?
The IUPAC name of 2-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide (CID 88832844) is 2-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide.
What is the SMILES notation for 2-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide?
The canonical SMILES for 2-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide is C=C(C)/C(=N\C(C)C)NC(C)C.
What is the InChIKey of 2-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide?
The InChIKey is ZPQJIRNBBIEEKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-7(2)10(11-8(3)4)12-9(5)6/h8-9H,1H2,2-6H3,(H,11,12).
What are the key properties of 2-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide?
2-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide has a molecular weight of 168.28 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N,N'-di(propan-2-yl)prop-2-enimidamide is sourced from PubChem (CID 88832844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).