N-methyl-2-morpholin-3-yl-N-[2-(1H-pyrrol-2-yl)ethyl]acetamide

C13H21N3O2 — CID 115178159

IUPACN-methyl-2-morpholin-3-yl-N-[2-(1H-pyrrol-2-yl)ethyl]acetamide
SMILESCN(CCc1ccc[nH]1)C(=O)CC1COCCN1
InChIInChI=1S/C13H21N3O2/c1-16(7-4-11-3-2-5-14-11)13(17)9-12-10-18-8-6-15-12/h2-3,5,12,14-15H,4,6-10H2,1H3
InChIKeyGCIPKXWBGATCPQ-UHFFFAOYSA-N
MW251.33 g/mol
LogP0.39
Rot. Bonds5

About N-methyl-2-morpholin-3-yl-N-[2-(1H-pyrrol-2-yl)ethyl]acetamide

N-methyl-2-morpholin-3-yl-N-[2-(1H-pyrrol-2-yl)ethyl]acetamide (PubChem CID 115178159) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is N-methyl-2-morpholin-3-yl-N-[2-(1H-pyrrol-2-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-methyl-2-morpholin-3-yl-N-[2-(1H-pyrrol-2-yl)ethyl]acetamide
PubChem CID115178159
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC NameN-methyl-2-morpholin-3-yl-N-[2-(1H-pyrrol-2-yl)ethyl]acetamide
SMILESCN(CCc1ccc[nH]1)C(=O)CC1COCCN1
InChIInChI=1S/C13H21N3O2/c1-16(7-4-11-3-2-5-14-11)13(17)9-12-10-18-8-6-15-12/h2-3,5,12,14-15H,4,6-10H2,1H3
InChIKeyGCIPKXWBGATCPQ-UHFFFAOYSA-N
XLogP0.39
TPSA57.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-methyl-2-morpholin-3-yl-N-[2-(1H-pyrrol-2-yl)ethyl]acetamide with MolForge

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

Launch Full Analysis

Related Compounds

N-methyl-2-morpholin-3-yl-N-(1H-pyrrol-2-ylmethyl)ethanamine
CID 115238990
N-methyl-2-morpholin-3-yl-N-(1H-pyrrol-3-ylmethyl)acetamide
CID 115178144
N-methyl-2-[(3R)-morpholin-3-yl]-N-[(4-phenoxyphenyl)methyl]acetamide
CID 96572362
3-chloro-N-methyl-N-[2-(1H-pyrrol-2-yl)ethyl]propanamide
CID 115162696
3-amino-N-methyl-N-[2-(1H-pyrrol-2-yl)ethyl]propanamide
CID 115153081
N-[(5-bromothiophen-2-yl)methyl]-N-methyl-2-morpholin-3-ylacetamide
CID 115178142
N-(1-methylpiperidin-4-yl)-2-morpholin-3-yl-N-(2-phenylethyl)acetamide;dihydrochloride
CID 154893914
N-methyl-2-[(3S)-morpholin-3-yl]-N-[(1S)-1-pyridin-4-ylethyl]acetamide
CID 129381345
2-[(3R)-morpholin-3-yl]-1-phenylethanone
CID 95396636
2-morpholin-3-yl-1-phenylethanone
CID 14753828
N-methyl-N-(2-phenylethyl)-2-pyrrolidin-2-ylacetamide
CID 61365250
2-(hydroxymethyl)-N-methyl-N-[2-(1H-pyrrol-2-yl)ethyl]butanamide
CID 115186753

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-morpholin-3-yl-N-[2-(1H-pyrrol-2-yl)ethyl]acetamide?
The IUPAC name of N-methyl-2-morpholin-3-yl-N-[2-(1H-pyrrol-2-yl)ethyl]acetamide (CID 115178159) is N-methyl-2-morpholin-3-yl-N-[2-(1H-pyrrol-2-yl)ethyl]acetamide.
What is the SMILES notation for N-methyl-2-morpholin-3-yl-N-[2-(1H-pyrrol-2-yl)ethyl]acetamide?
The canonical SMILES for N-methyl-2-morpholin-3-yl-N-[2-(1H-pyrrol-2-yl)ethyl]acetamide is CN(CCc1ccc[nH]1)C(=O)CC1COCCN1.
What is the InChIKey of N-methyl-2-morpholin-3-yl-N-[2-(1H-pyrrol-2-yl)ethyl]acetamide?
The InChIKey is GCIPKXWBGATCPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2/c1-16(7-4-11-3-2-5-14-11)13(17)9-12-10-18-8-6-15-12/h2-3,5,12,14-15H,4,6-10H2,1H3.
What are the key properties of N-methyl-2-morpholin-3-yl-N-[2-(1H-pyrrol-2-yl)ethyl]acetamide?
N-methyl-2-morpholin-3-yl-N-[2-(1H-pyrrol-2-yl)ethyl]acetamide has a molecular weight of 251.33 g/mol, XLogP of 0.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-morpholin-3-yl-N-[2-(1H-pyrrol-2-yl)ethyl]acetamide is sourced from PubChem (CID 115178159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).