N'-[1-[2-methoxyethyl(methyl)amino]ethenyl]-N-methylidenemorpholine-4-carboximidamide

C12H22N4O2 — CID 123763340

IUPACN'-[1-[2-methoxyethyl(methyl)amino]ethenyl]-N-methylidenemorpholine-4-carboximidamide
SMILESC=NC(=NC(=C)N(C)CCOC)N1CCOCC1
InChIInChI=1S/C12H22N4O2/c1-11(15(3)5-8-17-4)14-12(13-2)16-6-9-18-10-7-16/h1-2,5-10H2,3-4H3
InChIKeyYMODUQDTSXIETF-UHFFFAOYSA-N
MW254.33 g/mol
LogP0.42
Rot. Bonds5

About N'-[1-[2-methoxyethyl(methyl)amino]ethenyl]-N-methylidenemorpholine-4-carboximidamide

N'-[1-[2-methoxyethyl(methyl)amino]ethenyl]-N-methylidenemorpholine-4-carboximidamide (PubChem CID 123763340) has the molecular formula C12H22N4O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is N'-[1-[2-methoxyethyl(methyl)amino]ethenyl]-N-methylidenemorpholine-4-carboximidamide.

Molecular Properties

Compound NameN'-[1-[2-methoxyethyl(methyl)amino]ethenyl]-N-methylidenemorpholine-4-carboximidamide
PubChem CID123763340
Molecular FormulaC12H22N4O2
Molecular Weight254.33 g/mol
Exact Mass254.17
IUPAC NameN'-[1-[2-methoxyethyl(methyl)amino]ethenyl]-N-methylidenemorpholine-4-carboximidamide
SMILESC=NC(=NC(=C)N(C)CCOC)N1CCOCC1
InChIInChI=1S/C12H22N4O2/c1-11(15(3)5-8-17-4)14-12(13-2)16-6-9-18-10-7-16/h1-2,5-10H2,3-4H3
InChIKeyYMODUQDTSXIETF-UHFFFAOYSA-N
XLogP0.42
TPSA49.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 50.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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-methylmorpholine-4-carboxamide
CID 115589220
N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)morpholine-4-carboxamide
CID 115672440
N-(2-hydroxyethyl)-N-(2-methoxyethyl)morpholine-4-carboxamide
CID 115608967
2-[2-methoxyethyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetic acid
CID 54969051
2-[3-aminopropyl(2-methoxyethyl)amino]-1-morpholin-4-ylpropan-1-one
CID 63287403
N,N-dimethyl-1-morpholin-4-ylethenamine
CID 142039322
2-[[amino(morpholin-4-yl)methylidene]amino]-N-(2-methoxyethyl)acetamide
CID 111036986
N-(2-cyanoethyl)-N-(2-methoxyethyl)morpholine-4-carboxamide
CID 79156132
N-(3-methoxypropyl)morpholine-4-carboxamide
CID 3136313
N-[2-(4-methoxyphenoxy)ethyl]-N-methylmorpholine-4-carboxamide
CID 136542154
2-methoxyethyl (NZ)-N-(2-methyl-1-morpholin-4-ylpropylidene)carbamate
CID 142123394
5-methoxy-3-methylidene-N-(2-morpholin-4-ylethyl)-N-propylpentan-1-amine
CID 143677808

Frequently Asked Questions

What is the IUPAC name of N'-[1-[2-methoxyethyl(methyl)amino]ethenyl]-N-methylidenemorpholine-4-carboximidamide?
The IUPAC name of N'-[1-[2-methoxyethyl(methyl)amino]ethenyl]-N-methylidenemorpholine-4-carboximidamide (CID 123763340) is N'-[1-[2-methoxyethyl(methyl)amino]ethenyl]-N-methylidenemorpholine-4-carboximidamide.
What is the SMILES notation for N'-[1-[2-methoxyethyl(methyl)amino]ethenyl]-N-methylidenemorpholine-4-carboximidamide?
The canonical SMILES for N'-[1-[2-methoxyethyl(methyl)amino]ethenyl]-N-methylidenemorpholine-4-carboximidamide is C=NC(=NC(=C)N(C)CCOC)N1CCOCC1.
What is the InChIKey of N'-[1-[2-methoxyethyl(methyl)amino]ethenyl]-N-methylidenemorpholine-4-carboximidamide?
The InChIKey is YMODUQDTSXIETF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O2/c1-11(15(3)5-8-17-4)14-12(13-2)16-6-9-18-10-7-16/h1-2,5-10H2,3-4H3.
What are the key properties of N'-[1-[2-methoxyethyl(methyl)amino]ethenyl]-N-methylidenemorpholine-4-carboximidamide?
N'-[1-[2-methoxyethyl(methyl)amino]ethenyl]-N-methylidenemorpholine-4-carboximidamide has a molecular weight of 254.33 g/mol, XLogP of 0.42, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[1-[2-methoxyethyl(methyl)amino]ethenyl]-N-methylidenemorpholine-4-carboximidamide is sourced from PubChem (CID 123763340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).