N'-methyl-N-(2-methylcyclopropyl)-3-morpholin-4-ylpyrrolidine-1-carboximidamide

C14H26N4O — CID 111726217

IUPACN'-methyl-N-(2-methylcyclopropyl)-3-morpholin-4-ylpyrrolidine-1-carboximidamide
SMILESC/N=C(/NC1CC1C)N1CCC(N2CCOCC2)C1
InChIInChI=1S/C14H26N4O/c1-11-9-13(11)16-14(15-2)18-4-3-12(10-18)17-5-7-19-8-6-17/h11-13H,3-10H2,1-2H3,(H,15,16)
InChIKeyIEVRZFLIFDHQEA-UHFFFAOYSA-N
MW266.39 g/mol
LogP0.38
Rot. Bonds2

About N'-methyl-N-(2-methylcyclopropyl)-3-morpholin-4-ylpyrrolidine-1-carboximidamide

N'-methyl-N-(2-methylcyclopropyl)-3-morpholin-4-ylpyrrolidine-1-carboximidamide (PubChem CID 111726217) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is N'-methyl-N-(2-methylcyclopropyl)-3-morpholin-4-ylpyrrolidine-1-carboximidamide.

Molecular Properties

Compound NameN'-methyl-N-(2-methylcyclopropyl)-3-morpholin-4-ylpyrrolidine-1-carboximidamide
PubChem CID111726217
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC NameN'-methyl-N-(2-methylcyclopropyl)-3-morpholin-4-ylpyrrolidine-1-carboximidamide
SMILESC/N=C(/NC1CC1C)N1CCC(N2CCOCC2)C1
InChIInChI=1S/C14H26N4O/c1-11-9-13(11)16-14(15-2)18-4-3-12(10-18)17-5-7-19-8-6-17/h11-13H,3-10H2,1-2H3,(H,15,16)
InChIKeyIEVRZFLIFDHQEA-UHFFFAOYSA-N
XLogP0.38
TPSA40.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 50.38
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'-ethyl-N-(2-methylcyclopropyl)-3-morpholin-4-ylpyrrolidine-1-carboximidamide;hydroiodide
CID 111727246
N-[2-(4-bromophenyl)cyclopropyl]-N'-methyl-3-morpholin-4-ylpyrrolidine-1-carboximidamide;hydroiodide
CID 111725788
N-butyl-N'-methyl-3-morpholin-4-ylpyrrolidine-1-carboximidamide
CID 111726567
N'-methyl-N-(4-methylpentyl)-3-morpholin-4-ylpyrrolidine-1-carboximidamide
CID 111726361
N-(cyclooctylmethyl)-N'-methyl-3-morpholin-4-ylpyrrolidine-1-carboximidamide;hydroiodide
CID 111728150
N'-methyl-3-morpholin-4-yl-N-(oxolan-3-ylmethyl)pyrrolidine-1-carboximidamide;hydroiodide
CID 119142608
N-(8,8-dimethyl-2-oxabicyclo[4.2.0]octan-7-yl)-N'-methyl-3-morpholin-4-ylpyrrolidine-1-carboximidamide;hydroiodide
CID 119162117
N',3,5-trimethyl-N-(2-methylcyclopropyl)piperidine-1-carboximidamide
CID 111153377
N'-methyl-N-[3-(4-methylpiperidin-1-yl)propyl]-3-morpholin-4-ylpyrrolidine-1-carboximidamide;hydroiodide
CID 111725748
N-[(1-ethylpyrrolidin-2-yl)methyl]-N'-methyl-3-morpholin-4-ylpyrrolidine-1-carboximidamide;hydroiodide
CID 111728226
N-(3-methoxypropyl)-N'-methyl-3-morpholin-4-ylpyrrolidine-1-carboximidamide;hydroiodide
CID 111726310
N',3-dimethyl-N-(2-methylcyclopropyl)piperidine-1-carboximidamide;hydroiodide
CID 111144201

Frequently Asked Questions

What is the IUPAC name of N'-methyl-N-(2-methylcyclopropyl)-3-morpholin-4-ylpyrrolidine-1-carboximidamide?
The IUPAC name of N'-methyl-N-(2-methylcyclopropyl)-3-morpholin-4-ylpyrrolidine-1-carboximidamide (CID 111726217) is N'-methyl-N-(2-methylcyclopropyl)-3-morpholin-4-ylpyrrolidine-1-carboximidamide.
What is the SMILES notation for N'-methyl-N-(2-methylcyclopropyl)-3-morpholin-4-ylpyrrolidine-1-carboximidamide?
The canonical SMILES for N'-methyl-N-(2-methylcyclopropyl)-3-morpholin-4-ylpyrrolidine-1-carboximidamide is C/N=C(/NC1CC1C)N1CCC(N2CCOCC2)C1.
What is the InChIKey of N'-methyl-N-(2-methylcyclopropyl)-3-morpholin-4-ylpyrrolidine-1-carboximidamide?
The InChIKey is IEVRZFLIFDHQEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-11-9-13(11)16-14(15-2)18-4-3-12(10-18)17-5-7-19-8-6-17/h11-13H,3-10H2,1-2H3,(H,15,16).
What are the key properties of N'-methyl-N-(2-methylcyclopropyl)-3-morpholin-4-ylpyrrolidine-1-carboximidamide?
N'-methyl-N-(2-methylcyclopropyl)-3-morpholin-4-ylpyrrolidine-1-carboximidamide has a molecular weight of 266.39 g/mol, XLogP of 0.38, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N-(2-methylcyclopropyl)-3-morpholin-4-ylpyrrolidine-1-carboximidamide is sourced from PubChem (CID 111726217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).