N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2-dimethylpropanimidamide

C12H26N2O2 — CID 63177457

IUPACN-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2-dimethylpropanimidamide
SMILES[H]/N=C(/N(CCOC)C(C)COC)C(C)(C)C
InChIInChI=1S/C12H26N2O2/c1-10(9-16-6)14(7-8-15-5)11(13)12(2,3)4/h10,13H,7-9H2,1-6H3/b13-11+
InChIKeyIKDWQIGBVYXPPR-ACCUITESSA-N
MW230.35 g/mol
LogP1.99
Rot. Bonds6

About N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2-dimethylpropanimidamide

N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2-dimethylpropanimidamide (PubChem CID 63177457) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2-dimethylpropanimidamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2-dimethylpropanimidamide
PubChem CID63177457
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC NameN-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2-dimethylpropanimidamide
SMILES[H]/N=C(/N(CCOC)C(C)COC)C(C)(C)C
InChIInChI=1S/C12H26N2O2/c1-10(9-16-6)14(7-8-15-5)11(13)12(2,3)4/h10,13H,7-9H2,1-6H3/b13-11+
InChIKeyIKDWQIGBVYXPPR-ACCUITESSA-N
XLogP1.99
TPSA45.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)cyclopentanecarboximidamide
CID 63177458
2-bromo-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2-methylpropanamide
CID 114328513
2-(ethylamino)-4-[2-methoxyethyl(propan-2-yl)amino]-2-methylbutanamide
CID 82959553
4-[2-methoxyethyl(propan-2-yl)amino]-2,2-dimethylbutanimidamide
CID 82951402
2-(ethylamino)-N-(2-methoxyethyl)-2-methyl-N-propan-2-ylpropanamide
CID 82948013
3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-2,2-dimethylpropan-1-ol
CID 62266357
5-[1-methoxypropan-2-yl(methyl)amino]-2,2-dimethylpentanimidamide
CID 65258029
2-[[2-methoxyethyl(1-methoxypropan-2-yl)carbamoyl]amino]propanoic acid
CID 55004090
N-butan-2-yl-N-(2-methoxyethyl)-2-methyl-2-(methylamino)propanamide
CID 62845655
5-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-3-methyl-5-oxopentanoic acid
CID 62965265
N-ethyl-N-[(2R)-1-methoxypropan-2-yl]piperidine-4-carboximidamide
CID 166705160
N-(2-methoxyethyl)-N-pentan-3-ylcyclohexanecarboximidamide
CID 63178188

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2-dimethylpropanimidamide?
The IUPAC name of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2-dimethylpropanimidamide (CID 63177457) is N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2-dimethylpropanimidamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2-dimethylpropanimidamide?
The canonical SMILES for N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2-dimethylpropanimidamide is [H]/N=C(/N(CCOC)C(C)COC)C(C)(C)C.
What is the InChIKey of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2-dimethylpropanimidamide?
The InChIKey is IKDWQIGBVYXPPR-ACCUITESSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-10(9-16-6)14(7-8-15-5)11(13)12(2,3)4/h10,13H,7-9H2,1-6H3/b13-11+.
What are the key properties of N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2-dimethylpropanimidamide?
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2-dimethylpropanimidamide has a molecular weight of 230.35 g/mol, XLogP of 1.99, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-2,2-dimethylpropanimidamide is sourced from PubChem (CID 63177457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).