N-[2-(dimethylamino)ethyl]-2-methyl-N-[(5-methylfuran-2-yl)methyl]pyrrolidine-3-carboxamide

C16H27N3O2 — CID 79379409

IUPACN-[2-(dimethylamino)ethyl]-2-methyl-N-[(5-methylfuran-2-yl)methyl]pyrrolidine-3-carboxamide
SMILESCc1ccc(CN(CCN(C)C)C(=O)C2CCNC2C)o1
InChIInChI=1S/C16H27N3O2/c1-12-5-6-14(21-12)11-19(10-9-18(3)4)16(20)15-7-8-17-13(15)2/h5-6,13,15,17H,7-11H2,1-4H3
InChIKeyYCECCSNHQRHDFC-UHFFFAOYSA-N
MW293.41 g/mol
LogP1.48
Rot. Bonds6

About N-[2-(dimethylamino)ethyl]-2-methyl-N-[(5-methylfuran-2-yl)methyl]pyrrolidine-3-carboxamide

N-[2-(dimethylamino)ethyl]-2-methyl-N-[(5-methylfuran-2-yl)methyl]pyrrolidine-3-carboxamide (PubChem CID 79379409) has the molecular formula C16H27N3O2 and a molecular weight of 293.41 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-2-methyl-N-[(5-methylfuran-2-yl)methyl]pyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-2-methyl-N-[(5-methylfuran-2-yl)methyl]pyrrolidine-3-carboxamide
PubChem CID79379409
Molecular FormulaC16H27N3O2
Molecular Weight293.41 g/mol
Exact Mass293.21
IUPAC NameN-[2-(dimethylamino)ethyl]-2-methyl-N-[(5-methylfuran-2-yl)methyl]pyrrolidine-3-carboxamide
SMILESCc1ccc(CN(CCN(C)C)C(=O)C2CCNC2C)o1
InChIInChI=1S/C16H27N3O2/c1-12-5-6-14(21-12)11-19(10-9-18(3)4)16(20)15-7-8-17-13(15)2/h5-6,13,15,17H,7-11H2,1-4H3
InChIKeyYCECCSNHQRHDFC-UHFFFAOYSA-N
XLogP1.48
TPSA48.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-(dimethylamino)ethyl]-2-methyl-N-[(5-methylfuran-2-yl)methyl]pyrrolidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-2-methyl-N-[(5-methylfuran-2-yl)methyl]pyrrolidine-3-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-2-methyl-N-[(5-methylfuran-2-yl)methyl]pyrrolidine-3-carboxamide (CID 79379409) is N-[2-(dimethylamino)ethyl]-2-methyl-N-[(5-methylfuran-2-yl)methyl]pyrrolidine-3-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-2-methyl-N-[(5-methylfuran-2-yl)methyl]pyrrolidine-3-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-2-methyl-N-[(5-methylfuran-2-yl)methyl]pyrrolidine-3-carboxamide is Cc1ccc(CN(CCN(C)C)C(=O)C2CCNC2C)o1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-2-methyl-N-[(5-methylfuran-2-yl)methyl]pyrrolidine-3-carboxamide?
The InChIKey is YCECCSNHQRHDFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O2/c1-12-5-6-14(21-12)11-19(10-9-18(3)4)16(20)15-7-8-17-13(15)2/h5-6,13,15,17H,7-11H2,1-4H3.
What are the key properties of N-[2-(dimethylamino)ethyl]-2-methyl-N-[(5-methylfuran-2-yl)methyl]pyrrolidine-3-carboxamide?
N-[2-(dimethylamino)ethyl]-2-methyl-N-[(5-methylfuran-2-yl)methyl]pyrrolidine-3-carboxamide has a molecular weight of 293.41 g/mol, XLogP of 1.48, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-2-methyl-N-[(5-methylfuran-2-yl)methyl]pyrrolidine-3-carboxamide is sourced from PubChem (CID 79379409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).