potassium;carbanide;ethane;N-[[4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]-N-methylformamide

C14H32KN3O2 — CID 164557349

IUPACpotassium;carbanide;ethane;N-[[4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]-N-methylformamide
SMILESCC.CCNCCN1CCOC(CN(C)C=O)C1.[CH3-].[K+]
InChIInChI=1S/C11H23N3O2.C2H6.CH3.K/c1-3-12-4-5-14-6-7-16-11(9-14)8-13(2)10-15;1-2;;/h10-12H,3-9H2,1-2H3;1-2H3;1H3;/q;;-1;+1
InChIKeyXSZPNFMISDBSIV-UHFFFAOYSA-N
MW313.53 g/mol
LogP-2.13
Rot. Bonds7

About potassium;carbanide;ethane;N-[[4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]-N-methylformamide

potassium;carbanide;ethane;N-[[4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]-N-methylformamide (PubChem CID 164557349) has the molecular formula C14H32KN3O2 and a molecular weight of 313.53 g/mol. Its IUPAC name is potassium;carbanide;ethane;N-[[4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]-N-methylformamide.

Molecular Properties

Compound Namepotassium;carbanide;ethane;N-[[4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]-N-methylformamide
PubChem CID164557349
Molecular FormulaC14H32KN3O2
Molecular Weight313.53 g/mol
Exact Mass313.21
IUPAC Namepotassium;carbanide;ethane;N-[[4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]-N-methylformamide
SMILESCC.CCNCCN1CCOC(CN(C)C=O)C1.[CH3-].[K+]
InChIInChI=1S/C11H23N3O2.C2H6.CH3.K/c1-3-12-4-5-14-6-7-16-11(9-14)8-13(2)10-15;1-2;;/h10-12H,3-9H2,1-2H3;1-2H3;1H3;/q;;-1;+1
InChIKeyXSZPNFMISDBSIV-UHFFFAOYSA-N
XLogP-2.13
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.53
LogP ≤ 5-2.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze potassium;carbanide;ethane;N-[[4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]-N-methylformamide with MolForge

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Related Compounds

ethane;N-[[(2S)-4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]-N,2-dimethylpropan-1-amine;molecular hydrogen
CID 171539494
N-[[4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]propan-1-amine
CID 155707218
N-methyl-N-[[(2S)-4-[2-(propylamino)ethyl]morpholin-2-yl]methyl]acetamide
CID 170064550
N-[[(2S)-4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]-2-methylpropan-1-amine
CID 155188422
N,N'-diethyl-N'-[(4-ethylmorpholin-2-yl)methyl]ethane-1,2-diamine
CID 79171654
N,2-dimethyl-N-[[(2S)-4-[2-(propylamino)ethyl]morpholin-2-yl]methyl]propan-1-amine
CID 166800661
N-[[(2S)-4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]butanamide
CID 155739567
N-[(4-ethylmorpholin-2-yl)methyl]-N-methylethenamine
CID 169213885
N-[2-[(2R)-2-[2-(ethylamino)ethyl]morpholin-4-yl]ethyl]-N,2-dimethylpropan-1-amine
CID 167191852
N-methyl-N-[[(2R)-4-[2-(2-methylpropylamino)ethyl]morpholin-2-yl]methyl]-2-sulfanylpropanamide
CID 167243582
N-[2-(2-ethylmorpholin-4-yl)ethyl]-3,3-dimethylbutan-1-amine
CID 62561718
3-[2-[(dimethylamino)methyl]morpholin-4-yl]-N-methylpropan-1-amine
CID 157048783

Frequently Asked Questions

What is the IUPAC name of potassium;carbanide;ethane;N-[[4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]-N-methylformamide?
The IUPAC name of potassium;carbanide;ethane;N-[[4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]-N-methylformamide (CID 164557349) is potassium;carbanide;ethane;N-[[4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]-N-methylformamide.
What is the SMILES notation for potassium;carbanide;ethane;N-[[4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]-N-methylformamide?
The canonical SMILES for potassium;carbanide;ethane;N-[[4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]-N-methylformamide is CC.CCNCCN1CCOC(CN(C)C=O)C1.[CH3-].[K+].
What is the InChIKey of potassium;carbanide;ethane;N-[[4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]-N-methylformamide?
The InChIKey is XSZPNFMISDBSIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2.C2H6.CH3.K/c1-3-12-4-5-14-6-7-16-11(9-14)8-13(2)10-15;1-2;;/h10-12H,3-9H2,1-2H3;1-2H3;1H3;/q;;-1;+1.
What are the key properties of potassium;carbanide;ethane;N-[[4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]-N-methylformamide?
potassium;carbanide;ethane;N-[[4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]-N-methylformamide has a molecular weight of 313.53 g/mol, XLogP of -2.13, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;carbanide;ethane;N-[[4-[2-(ethylamino)ethyl]morpholin-2-yl]methyl]-N-methylformamide is sourced from PubChem (CID 164557349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).