ethane;N-methyl-N-(1-methylpyrrolidin-3-yl)propanamide;yttrium

C11H23N2OY- — CID 160588404

IUPACethane;N-methyl-N-(1-methylpyrrolidin-3-yl)propanamide;yttrium
SMILESCC.C[CH-]C(=O)N(C)C1CCN(C)C1.[Y]
InChIInChI=1S/C9H17N2O.C2H6.Y/c1-4-9(12)11(3)8-5-6-10(2)7-8;1-2;/h4,8H,5-7H2,1-3H3;1-2H3;/q-1;;
InChIKeyYTGROHVDXLMRBG-UHFFFAOYSA-N
MW288.22 g/mol
LogP1.40
Rot. Bonds2

About ethane;N-methyl-N-(1-methylpyrrolidin-3-yl)propanamide;yttrium

ethane;N-methyl-N-(1-methylpyrrolidin-3-yl)propanamide;yttrium (PubChem CID 160588404) has the molecular formula C11H23N2OY- and a molecular weight of 288.22 g/mol. Its IUPAC name is ethane;N-methyl-N-(1-methylpyrrolidin-3-yl)propanamide;yttrium.

Molecular Properties

Compound Nameethane;N-methyl-N-(1-methylpyrrolidin-3-yl)propanamide;yttrium
PubChem CID160588404
Molecular FormulaC11H23N2OY-
Molecular Weight288.22 g/mol
Exact Mass288.09
IUPAC Nameethane;N-methyl-N-(1-methylpyrrolidin-3-yl)propanamide;yttrium
SMILESCC.C[CH-]C(=O)N(C)C1CCN(C)C1.[Y]
InChIInChI=1S/C9H17N2O.C2H6.Y/c1-4-9(12)11(3)8-5-6-10(2)7-8;1-2;/h4,8H,5-7H2,1-3H3;1-2H3;/q-1;;
InChIKeyYTGROHVDXLMRBG-UHFFFAOYSA-N
XLogP1.40
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.22
LogP ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-methyl-N-[(3S)-1-methylpyrrolidin-3-yl]acetamide
CID 66565800
N,3-dimethyl-N-(1-methylpyrrolidin-3-yl)but-2-enamide
CID 130598254
ethane;N-methyl-N-(1-methylpyrrolidin-3-yl)formamide
CID 143070615
N-methyl-N-(1-methylpyrrolidin-3-yl)-3-oxopentanamide
CID 59675990
1-methyl-1-(1-methylpiperidin-3-yl)urea
CID 62546065
(3S)-N,N,1-trimethylpyrrolidin-3-amine
CID 59975379
2-cyano-N,2-dimethyl-N-(1-methylpyrrolidin-3-yl)propanamide
CID 115175075
3-amino-N,2,2-trimethyl-N-(1-methylpyrrolidin-3-yl)propanamide
CID 115154624
N-methyl-N-(1-methylpiperidin-3-yl)-2-oxopropanamide
CID 115175567
4-(aminomethyl)-N-methyl-N-(1-methylpyrrolidin-3-yl)cyclohexane-1-carboxamide
CID 115151057
3-cyano-N-methyl-N-(1-methylpyrrolidin-3-yl)propanamide
CID 115173733
1-(aminomethyl)-N-methyl-N-(1-methylpyrrolidin-3-yl)cyclopropane-1-carboxamide
CID 115182657

Frequently Asked Questions

What is the IUPAC name of ethane;N-methyl-N-(1-methylpyrrolidin-3-yl)propanamide;yttrium?
The IUPAC name of ethane;N-methyl-N-(1-methylpyrrolidin-3-yl)propanamide;yttrium (CID 160588404) is ethane;N-methyl-N-(1-methylpyrrolidin-3-yl)propanamide;yttrium.
What is the SMILES notation for ethane;N-methyl-N-(1-methylpyrrolidin-3-yl)propanamide;yttrium?
The canonical SMILES for ethane;N-methyl-N-(1-methylpyrrolidin-3-yl)propanamide;yttrium is CC.C[CH-]C(=O)N(C)C1CCN(C)C1.[Y].
What is the InChIKey of ethane;N-methyl-N-(1-methylpyrrolidin-3-yl)propanamide;yttrium?
The InChIKey is YTGROHVDXLMRBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N2O.C2H6.Y/c1-4-9(12)11(3)8-5-6-10(2)7-8;1-2;/h4,8H,5-7H2,1-3H3;1-2H3;/q-1;;.
What are the key properties of ethane;N-methyl-N-(1-methylpyrrolidin-3-yl)propanamide;yttrium?
ethane;N-methyl-N-(1-methylpyrrolidin-3-yl)propanamide;yttrium has a molecular weight of 288.22 g/mol, XLogP of 1.40, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-methyl-N-(1-methylpyrrolidin-3-yl)propanamide;yttrium is sourced from PubChem (CID 160588404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).