N,2-dimethyl-N-(oxolan-2-ylmethyl)propanimidamide

C10H20N2O — CID 63177241

IUPACN,2-dimethyl-N-(oxolan-2-ylmethyl)propanimidamide
SMILES[H]/N=C(\C(C)C)N(C)CC1CCCO1
InChIInChI=1S/C10H20N2O/c1-8(2)10(11)12(3)7-9-5-4-6-13-9/h8-9,11H,4-7H2,1-3H3/b11-10+
InChIKeyWSWYFKPOJRVGBP-ZHACJKMWSA-N
MW184.28 g/mol
LogP1.73
Rot. Bonds3

About N,2-dimethyl-N-(oxolan-2-ylmethyl)propanimidamide

N,2-dimethyl-N-(oxolan-2-ylmethyl)propanimidamide (PubChem CID 63177241) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is N,2-dimethyl-N-(oxolan-2-ylmethyl)propanimidamide.

Molecular Properties

Compound NameN,2-dimethyl-N-(oxolan-2-ylmethyl)propanimidamide
PubChem CID63177241
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC NameN,2-dimethyl-N-(oxolan-2-ylmethyl)propanimidamide
SMILES[H]/N=C(\C(C)C)N(C)CC1CCCO1
InChIInChI=1S/C10H20N2O/c1-8(2)10(11)12(3)7-9-5-4-6-13-9/h8-9,11H,4-7H2,1-3H3/b11-10+
InChIKeyWSWYFKPOJRVGBP-ZHACJKMWSA-N
XLogP1.73
TPSA36.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.73
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,2-dimethyl-N-(oxolan-2-ylmethyl)propanamide
CID 61243218
1-methyl-1-(oxolan-2-ylmethyl)-3-propan-2-ylthiourea
CID 115594187
1-methyl-1-(oxolan-2-ylmethyl)-3-propan-2-ylurea
CID 110749026
methyl(oxolan-2-ylmethyl)carbamic acid
CID 90935828
2-methyl-3-[methyl(oxolan-2-ylmethyl)amino]propanimidamide
CID 61431841
3-[methyl(oxolan-2-ylmethyl)amino]butanimidamide
CID 61431844
(2S)-1-[methyl(oxolan-2-ylmethyl)amino]propan-2-ol
CID 103935026
N-methyl-N-(oxolan-2-ylmethyl)carbamoyl chloride
CID 79887071
N-methyl-N-(oxolan-2-ylmethyl)-2-(propan-2-ylamino)acetamide
CID 61436099
N,N-dimethyl-1-[(2S)-oxolan-2-yl]methanamine
CID 89026085
N-(oxolan-2-ylmethyl)-N-propan-2-ylpropan-2-amine
CID 22975536
1,3-dimethyl-1-(oxolan-2-ylmethyl)urea
CID 115590472

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-(oxolan-2-ylmethyl)propanimidamide?
The IUPAC name of N,2-dimethyl-N-(oxolan-2-ylmethyl)propanimidamide (CID 63177241) is N,2-dimethyl-N-(oxolan-2-ylmethyl)propanimidamide.
What is the SMILES notation for N,2-dimethyl-N-(oxolan-2-ylmethyl)propanimidamide?
The canonical SMILES for N,2-dimethyl-N-(oxolan-2-ylmethyl)propanimidamide is [H]/N=C(\C(C)C)N(C)CC1CCCO1.
What is the InChIKey of N,2-dimethyl-N-(oxolan-2-ylmethyl)propanimidamide?
The InChIKey is WSWYFKPOJRVGBP-ZHACJKMWSA-N. The full InChI is InChI=1S/C10H20N2O/c1-8(2)10(11)12(3)7-9-5-4-6-13-9/h8-9,11H,4-7H2,1-3H3/b11-10+.
What are the key properties of N,2-dimethyl-N-(oxolan-2-ylmethyl)propanimidamide?
N,2-dimethyl-N-(oxolan-2-ylmethyl)propanimidamide has a molecular weight of 184.28 g/mol, XLogP of 1.73, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-(oxolan-2-ylmethyl)propanimidamide is sourced from PubChem (CID 63177241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).