2-(dimethylamino)ethyl N-(1-methylpyrrolidin-3-yl)carbamate

C10H21N3O2 — CID 58336213

IUPAC2-(dimethylamino)ethyl N-(1-methylpyrrolidin-3-yl)carbamate
SMILESCN(C)CCOC(=O)NC1CCN(C)C1
InChIInChI=1S/C10H21N3O2/c1-12(2)6-7-15-10(14)11-9-4-5-13(3)8-9/h9H,4-8H2,1-3H3,(H,11,14)
InChIKeyMSSWICCVLIWVHQ-UHFFFAOYSA-N
MW215.30 g/mol
LogP-0.02
Rot. Bonds4

About 2-(dimethylamino)ethyl N-(1-methylpyrrolidin-3-yl)carbamate

2-(dimethylamino)ethyl N-(1-methylpyrrolidin-3-yl)carbamate (PubChem CID 58336213) has the molecular formula C10H21N3O2 and a molecular weight of 215.30 g/mol. Its IUPAC name is 2-(dimethylamino)ethyl N-(1-methylpyrrolidin-3-yl)carbamate.

Molecular Properties

Compound Name2-(dimethylamino)ethyl N-(1-methylpyrrolidin-3-yl)carbamate
PubChem CID58336213
Molecular FormulaC10H21N3O2
Molecular Weight215.30 g/mol
Exact Mass215.16
IUPAC Name2-(dimethylamino)ethyl N-(1-methylpyrrolidin-3-yl)carbamate
SMILESCN(C)CCOC(=O)NC1CCN(C)C1
InChIInChI=1S/C10H21N3O2/c1-12(2)6-7-15-10(14)11-9-4-5-13(3)8-9/h9H,4-8H2,1-3H3,(H,11,14)
InChIKeyMSSWICCVLIWVHQ-UHFFFAOYSA-N
XLogP-0.02
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)ethyl N-(1-methylpyrrolidin-3-yl)carbamate?
The IUPAC name of 2-(dimethylamino)ethyl N-(1-methylpyrrolidin-3-yl)carbamate (CID 58336213) is 2-(dimethylamino)ethyl N-(1-methylpyrrolidin-3-yl)carbamate.
What is the SMILES notation for 2-(dimethylamino)ethyl N-(1-methylpyrrolidin-3-yl)carbamate?
The canonical SMILES for 2-(dimethylamino)ethyl N-(1-methylpyrrolidin-3-yl)carbamate is CN(C)CCOC(=O)NC1CCN(C)C1.
What is the InChIKey of 2-(dimethylamino)ethyl N-(1-methylpyrrolidin-3-yl)carbamate?
The InChIKey is MSSWICCVLIWVHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O2/c1-12(2)6-7-15-10(14)11-9-4-5-13(3)8-9/h9H,4-8H2,1-3H3,(H,11,14).
What are the key properties of 2-(dimethylamino)ethyl N-(1-methylpyrrolidin-3-yl)carbamate?
2-(dimethylamino)ethyl N-(1-methylpyrrolidin-3-yl)carbamate has a molecular weight of 215.30 g/mol, XLogP of -0.02, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)ethyl N-(1-methylpyrrolidin-3-yl)carbamate is sourced from PubChem (CID 58336213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).