N'-[2-(2-methoxyphenyl)ethyl]cyclopropanecarboximidamide

C13H18N2O — CID 106262569

IUPACN'-[2-(2-methoxyphenyl)ethyl]cyclopropanecarboximidamide
SMILESCOc1ccccc1CC/N=C(\N)C1CC1
InChIInChI=1S/C13H18N2O/c1-16-12-5-3-2-4-10(12)8-9-15-13(14)11-6-7-11/h2-5,11H,6-9H2,1H3,(H2,14,15)
InChIKeyKINVMUJEHNVPMO-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.00
Rot. Bonds5

About N'-[2-(2-methoxyphenyl)ethyl]cyclopropanecarboximidamide

N'-[2-(2-methoxyphenyl)ethyl]cyclopropanecarboximidamide (PubChem CID 106262569) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is N'-[2-(2-methoxyphenyl)ethyl]cyclopropanecarboximidamide.

Molecular Properties

Compound NameN'-[2-(2-methoxyphenyl)ethyl]cyclopropanecarboximidamide
PubChem CID106262569
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC NameN'-[2-(2-methoxyphenyl)ethyl]cyclopropanecarboximidamide
SMILESCOc1ccccc1CC/N=C(\N)C1CC1
InChIInChI=1S/C13H18N2O/c1-16-12-5-3-2-4-10(12)8-9-15-13(14)11-6-7-11/h2-5,11H,6-9H2,1H3,(H2,14,15)
InChIKeyKINVMUJEHNVPMO-UHFFFAOYSA-N
XLogP2.00
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.00
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-(2-methoxyphenyl)ethyl]propanimidamide
CID 106262572
1-(diaminomethylidene)-2-[2-(2-methoxyphenyl)ethyl]guanidine
CID 114165563
1-amino-3-cyclopentyl-2-[2-(2-methoxyphenyl)ethyl]guanidine
CID 106262763
1,3-diethyl-2-[2-(2-methoxyphenyl)ethyl]guanidine
CID 110913748
1,3-diethyl-2-[2-(2-methoxyphenyl)ethyl]guanidine;hydroiodide
CID 110913747
2-(2-methoxyphenyl)ethanamine;hydrochloride
CID 12626553
1-ethyl-2-[2-(2-methoxyphenyl)ethyl]-3-prop-2-ynylguanidine
CID 136922921
2-(2-methoxyphenyl)-N'-propylethanimidamide
CID 62049614
4-[[2-(2-methoxyphenyl)ethylamino]methyl]cyclohexan-1-amine
CID 115213507
N'-[(2-chlorophenyl)methyl]cyclopropanecarboximidamide
CID 63174432
N'-[2-(2-hydroxy-3-methoxyphenyl)ethyl]-3-methylpiperidine-1-carboximidamide;hydroiodide
CID 111100219
2-[2-(2-methoxyphenyl)ethyl]phenol
CID 10775715

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2-methoxyphenyl)ethyl]cyclopropanecarboximidamide?
The IUPAC name of N'-[2-(2-methoxyphenyl)ethyl]cyclopropanecarboximidamide (CID 106262569) is N'-[2-(2-methoxyphenyl)ethyl]cyclopropanecarboximidamide.
What is the SMILES notation for N'-[2-(2-methoxyphenyl)ethyl]cyclopropanecarboximidamide?
The canonical SMILES for N'-[2-(2-methoxyphenyl)ethyl]cyclopropanecarboximidamide is COc1ccccc1CC/N=C(\N)C1CC1.
What is the InChIKey of N'-[2-(2-methoxyphenyl)ethyl]cyclopropanecarboximidamide?
The InChIKey is KINVMUJEHNVPMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-16-12-5-3-2-4-10(12)8-9-15-13(14)11-6-7-11/h2-5,11H,6-9H2,1H3,(H2,14,15).
What are the key properties of N'-[2-(2-methoxyphenyl)ethyl]cyclopropanecarboximidamide?
N'-[2-(2-methoxyphenyl)ethyl]cyclopropanecarboximidamide has a molecular weight of 218.30 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2-methoxyphenyl)ethyl]cyclopropanecarboximidamide is sourced from PubChem (CID 106262569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).