N'-[tert-butyl(methyl)amino]-2,2-dimethyl-N-methylidenepropanimidamide

C11H23N3 — CID 166812636

IUPACN'-[tert-butyl(methyl)amino]-2,2-dimethyl-N-methylidenepropanimidamide
SMILESC=N/C(=N\N(C)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C11H23N3/c1-10(2,3)9(12-7)13-14(8)11(4,5)6/h7H2,1-6,8H3/b13-9-
InChIKeyBPKJKOYGFGBYQR-LCYFTJDESA-N
MW197.33 g/mol
LogP2.78
Rot. Bonds1

About N'-[tert-butyl(methyl)amino]-2,2-dimethyl-N-methylidenepropanimidamide

N'-[tert-butyl(methyl)amino]-2,2-dimethyl-N-methylidenepropanimidamide (PubChem CID 166812636) has the molecular formula C11H23N3 and a molecular weight of 197.33 g/mol. Its IUPAC name is N'-[tert-butyl(methyl)amino]-2,2-dimethyl-N-methylidenepropanimidamide.

Molecular Properties

Compound NameN'-[tert-butyl(methyl)amino]-2,2-dimethyl-N-methylidenepropanimidamide
PubChem CID166812636
Molecular FormulaC11H23N3
Molecular Weight197.33 g/mol
Exact Mass197.19
IUPAC NameN'-[tert-butyl(methyl)amino]-2,2-dimethyl-N-methylidenepropanimidamide
SMILESC=N/C(=N\N(C)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C11H23N3/c1-10(2,3)9(12-7)13-14(8)11(4,5)6/h7H2,1-6,8H3/b13-9-
InChIKeyBPKJKOYGFGBYQR-LCYFTJDESA-N
XLogP2.78
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.33
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(3Z)-3-[tert-butyl(methyl)hydrazinylidene]-1,1,1-trifluorononan-2-one
CID 102056444
(3Z)-3-[tert-butyl(methyl)hydrazinylidene]-1,1,1-trifluoro-5-methylhexan-2-one
CID 102056443
N'-(dimethylamino)-N-methylideneethanimidamide;ethane
CID 143697937
2-(dimethylamino)-1-methylideneguanidine
CID 145298608
N,3,3-trimethyl-N-methylideneboranylbut-1-en-2-amine
CID 174112129
N-[(3Z,5Z)-2,2-dimethylhepta-3,5-dien-3-yl]methanimine
CID 126494567
N-ethenyl-N,2-dimethylpropan-2-amine
CID 15241889
(Z)-1-N,3,3-trimethyl-1-N-(methylideneamino)but-1-ene-1,2-diamine
CID 170021824
N'-butyl-N-ethenyl-N,2,2-trimethylpropanimidamide
CID 129095407
(E)-N,N,3,4,4-pentamethylpent-2-en-2-amine
CID 166688460
methyl N'-(dimethylamino)-N-methylidenecarbamimidothioate
CID 126629611
(1Z,3Z)-N-tert-butyl-1-(methylideneamino)penta-1,3-dien-1-amine
CID 155138134

Frequently Asked Questions

What is the IUPAC name of N'-[tert-butyl(methyl)amino]-2,2-dimethyl-N-methylidenepropanimidamide?
The IUPAC name of N'-[tert-butyl(methyl)amino]-2,2-dimethyl-N-methylidenepropanimidamide (CID 166812636) is N'-[tert-butyl(methyl)amino]-2,2-dimethyl-N-methylidenepropanimidamide.
What is the SMILES notation for N'-[tert-butyl(methyl)amino]-2,2-dimethyl-N-methylidenepropanimidamide?
The canonical SMILES for N'-[tert-butyl(methyl)amino]-2,2-dimethyl-N-methylidenepropanimidamide is C=N/C(=N\N(C)C(C)(C)C)C(C)(C)C.
What is the InChIKey of N'-[tert-butyl(methyl)amino]-2,2-dimethyl-N-methylidenepropanimidamide?
The InChIKey is BPKJKOYGFGBYQR-LCYFTJDESA-N. The full InChI is InChI=1S/C11H23N3/c1-10(2,3)9(12-7)13-14(8)11(4,5)6/h7H2,1-6,8H3/b13-9-.
What are the key properties of N'-[tert-butyl(methyl)amino]-2,2-dimethyl-N-methylidenepropanimidamide?
N'-[tert-butyl(methyl)amino]-2,2-dimethyl-N-methylidenepropanimidamide has a molecular weight of 197.33 g/mol, XLogP of 2.78, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[tert-butyl(methyl)amino]-2,2-dimethyl-N-methylidenepropanimidamide is sourced from PubChem (CID 166812636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).