4-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrrolidine-3-carboxamide

C12H23N3O2 — CID 79083173

IUPAC4-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrrolidine-3-carboxamide
SMILESCC1CNCC1C(=O)NCC1CN(C)CCO1
InChIInChI=1S/C12H23N3O2/c1-9-5-13-7-11(9)12(16)14-6-10-8-15(2)3-4-17-10/h9-11,13H,3-8H2,1-2H3,(H,14,16)
InChIKeyBWNYOMXSURHITP-UHFFFAOYSA-N
MW241.33 g/mol
LogP-0.71
Rot. Bonds3

About 4-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrrolidine-3-carboxamide

4-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrrolidine-3-carboxamide (PubChem CID 79083173) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 4-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name4-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrrolidine-3-carboxamide
PubChem CID79083173
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name4-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrrolidine-3-carboxamide
SMILESCC1CNCC1C(=O)NCC1CN(C)CCO1
InChIInChI=1S/C12H23N3O2/c1-9-5-13-7-11(9)12(16)14-6-10-8-15(2)3-4-17-10/h9-11,13H,3-8H2,1-2H3,(H,14,16)
InChIKeyBWNYOMXSURHITP-UHFFFAOYSA-N
XLogP-0.71
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 5-0.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-N-[(4-methylmorpholin-2-yl)methyl]piperidine-3-carboxamide
CID 79071217
2-[(4-methylmorpholin-2-yl)methylcarbamoyl]cyclopentane-1-carboxylic acid
CID 113361141
2-amino-3-methyl-N-[(4-methylmorpholin-2-yl)methyl]cyclohexane-1-carboxamide
CID 79071178
2-(azetidin-3-yl)-N-[(4-methylmorpholin-2-yl)methyl]acetamide
CID 79083364
N-[(4-methylmorpholin-2-yl)methyl]acetamide
CID 69087754
N-[[(2S)-4-methylmorpholin-2-yl]methyl]acetamide
CID 170608678
4-methyl-1-[(4-methylmorpholin-2-yl)methylcarbamoyl]pyrrolidine-3-carboxylic acid
CID 79071056
4-amino-N-[(4-methylmorpholin-2-yl)methyl]cyclohexane-1-carboxamide
CID 79081947
3-amino-4-methyl-N-[(4-methylmorpholin-2-yl)methyl]cyclohexane-1-carboxamide
CID 79070990
N-[(4-methylmorpholin-2-yl)methyl]-1,3-thiazolidine-4-carboxamide
CID 79081953
2-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide
CID 153398973
methyl 2-[(4-methylmorpholin-2-yl)methylamino]-2-oxoacetate
CID 112617409

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrrolidine-3-carboxamide?
The IUPAC name of 4-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrrolidine-3-carboxamide (CID 79083173) is 4-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrrolidine-3-carboxamide.
What is the SMILES notation for 4-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrrolidine-3-carboxamide?
The canonical SMILES for 4-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrrolidine-3-carboxamide is CC1CNCC1C(=O)NCC1CN(C)CCO1.
What is the InChIKey of 4-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrrolidine-3-carboxamide?
The InChIKey is BWNYOMXSURHITP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-9-5-13-7-11(9)12(16)14-6-10-8-15(2)3-4-17-10/h9-11,13H,3-8H2,1-2H3,(H,14,16).
What are the key properties of 4-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrrolidine-3-carboxamide?
4-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrrolidine-3-carboxamide has a molecular weight of 241.33 g/mol, XLogP of -0.71, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(4-methylmorpholin-2-yl)methyl]pyrrolidine-3-carboxamide is sourced from PubChem (CID 79083173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).