N-methyl-N-(2-propan-2-yloxyethyl)butanimidamide

C10H22N2O — CID 81074511

IUPACN-methyl-N-(2-propan-2-yloxyethyl)butanimidamide
SMILES[H]/N=C(\CCC)N(C)CCOC(C)C
InChIInChI=1S/C10H22N2O/c1-5-6-10(11)12(4)7-8-13-9(2)3/h9,11H,5-8H2,1-4H3/b11-10+
InChIKeyMBMUMSZPRPSQGN-ZHACJKMWSA-N
MW186.30 g/mol
LogP2.12
Rot. Bonds6

About N-methyl-N-(2-propan-2-yloxyethyl)butanimidamide

N-methyl-N-(2-propan-2-yloxyethyl)butanimidamide (PubChem CID 81074511) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is N-methyl-N-(2-propan-2-yloxyethyl)butanimidamide.

Molecular Properties

Compound NameN-methyl-N-(2-propan-2-yloxyethyl)butanimidamide
PubChem CID81074511
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC NameN-methyl-N-(2-propan-2-yloxyethyl)butanimidamide
SMILES[H]/N=C(\CCC)N(C)CCOC(C)C
InChIInChI=1S/C10H22N2O/c1-5-6-10(11)12(4)7-8-13-9(2)3/h9,11H,5-8H2,1-4H3/b11-10+
InChIKeyMBMUMSZPRPSQGN-ZHACJKMWSA-N
XLogP2.12
TPSA36.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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,N-bis(2-ethoxyethyl)butanimidamide
CID 82959932
N-methyl-N-propylpropanimidamide
CID 63176074
N,N-dibutylbutanimidamide
CID 63175446
3-ethyl-1-methyl-1-(2-propan-2-yloxyethyl)urea
CID 115698202
(2R)-2-amino-N-methyl-N-(2-propan-2-yloxyethyl)butanamide
CID 81055167
N-methyl-6-propan-2-yloxy-N-(2-propan-2-yloxyethyl)hexanamide
CID 167520219
2-[bis(2-propan-2-yloxyethyl)amino]ethanol
CID 138492031
ethane;N-(2-methoxyethyl)-N,2-dimethylpropanimidamide
CID 143160692
3-amino-1-methyl-1-(2-propan-2-yloxyethyl)urea
CID 81062243
N-methyl-N-[(4-methylphenyl)methyl]butanimidamide
CID 63175757
3-(iodoamino)-N-methyl-N-(2-propan-2-yloxyethyl)propanamide
CID 170371515
3-amino-2-ethyl-1-methyl-1-(2-propan-2-yloxyethyl)guanidine
CID 104887509

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-propan-2-yloxyethyl)butanimidamide?
The IUPAC name of N-methyl-N-(2-propan-2-yloxyethyl)butanimidamide (CID 81074511) is N-methyl-N-(2-propan-2-yloxyethyl)butanimidamide.
What is the SMILES notation for N-methyl-N-(2-propan-2-yloxyethyl)butanimidamide?
The canonical SMILES for N-methyl-N-(2-propan-2-yloxyethyl)butanimidamide is [H]/N=C(\CCC)N(C)CCOC(C)C.
What is the InChIKey of N-methyl-N-(2-propan-2-yloxyethyl)butanimidamide?
The InChIKey is MBMUMSZPRPSQGN-ZHACJKMWSA-N. The full InChI is InChI=1S/C10H22N2O/c1-5-6-10(11)12(4)7-8-13-9(2)3/h9,11H,5-8H2,1-4H3/b11-10+.
What are the key properties of N-methyl-N-(2-propan-2-yloxyethyl)butanimidamide?
N-methyl-N-(2-propan-2-yloxyethyl)butanimidamide has a molecular weight of 186.30 g/mol, XLogP of 2.12, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-propan-2-yloxyethyl)butanimidamide is sourced from PubChem (CID 81074511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).