N-methyl-N-(2-methylbutan-2-yl)butanimidamide

C10H22N2 — CID 63962326

IUPACN-methyl-N-(2-methylbutan-2-yl)butanimidamide
SMILES[H]/N=C(\CCC)N(C)C(C)(C)CC
InChIInChI=1S/C10H22N2/c1-6-8-9(11)12(5)10(3,4)7-2/h11H,6-8H2,1-5H3/b11-9+
InChIKeyIHRVKWZEFSAQGA-PKNBQFBNSA-N
MW170.30 g/mol
LogP2.88
Rot. Bonds4

About N-methyl-N-(2-methylbutan-2-yl)butanimidamide

N-methyl-N-(2-methylbutan-2-yl)butanimidamide (PubChem CID 63962326) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is N-methyl-N-(2-methylbutan-2-yl)butanimidamide.

Molecular Properties

Compound NameN-methyl-N-(2-methylbutan-2-yl)butanimidamide
PubChem CID63962326
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC NameN-methyl-N-(2-methylbutan-2-yl)butanimidamide
SMILES[H]/N=C(\CCC)N(C)C(C)(C)CC
InChIInChI=1S/C10H22N2/c1-6-8-9(11)12(5)10(3,4)7-2/h11H,6-8H2,1-5H3/b11-9+
InChIKeyIHRVKWZEFSAQGA-PKNBQFBNSA-N
XLogP2.88
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 52.88
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-methyl-N-(2-methylbutan-2-yl)cyclopentanecarboximidamide
CID 63962537
N,N-dibutylbutanimidamide
CID 63175446
N-(2,2-dimethylpropyl)-N-methylpropanimidamide
CID 63177754
N,N-bis(2-ethoxyethyl)butanimidamide
CID 82959932
N-methyl-N-(2-propan-2-yloxyethyl)butanimidamide
CID 81074511
N-methyl-N-[(4-methylphenyl)methyl]butanimidamide
CID 63175757
N-[2-(dimethylamino)ethyl]-N-propylpropanimidamide
CID 63177323
N-methyl-N-propylpropanimidamide
CID 63176074
N-butyl-N-cyclopropylbutanimidamide
CID 63176623
2-[methyl(2-methylbutan-2-yl)amino]butanimidamide
CID 63981285
1,2-dimethyl-1-(2-methylbutan-2-yl)guanidine
CID 63958518
1,3-dimethyl-1-(2-methylbutan-2-yl)thiourea
CID 116508734

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylbutan-2-yl)butanimidamide?
The IUPAC name of N-methyl-N-(2-methylbutan-2-yl)butanimidamide (CID 63962326) is N-methyl-N-(2-methylbutan-2-yl)butanimidamide.
What is the SMILES notation for N-methyl-N-(2-methylbutan-2-yl)butanimidamide?
The canonical SMILES for N-methyl-N-(2-methylbutan-2-yl)butanimidamide is [H]/N=C(\CCC)N(C)C(C)(C)CC.
What is the InChIKey of N-methyl-N-(2-methylbutan-2-yl)butanimidamide?
The InChIKey is IHRVKWZEFSAQGA-PKNBQFBNSA-N. The full InChI is InChI=1S/C10H22N2/c1-6-8-9(11)12(5)10(3,4)7-2/h11H,6-8H2,1-5H3/b11-9+.
What are the key properties of N-methyl-N-(2-methylbutan-2-yl)butanimidamide?
N-methyl-N-(2-methylbutan-2-yl)butanimidamide has a molecular weight of 170.30 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylbutan-2-yl)butanimidamide is sourced from PubChem (CID 63962326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).