4-(3-aminocyclopentanecarbonyl)-N-methylmorpholine-3-carboxamide

C12H21N3O3 — CID 83098008

IUPAC4-(3-aminocyclopentanecarbonyl)-N-methylmorpholine-3-carboxamide
SMILESCNC(=O)C1COCCN1C(=O)C1CCC(N)C1
InChIInChI=1S/C12H21N3O3/c1-14-11(16)10-7-18-5-4-15(10)12(17)8-2-3-9(13)6-8/h8-10H,2-7,13H2,1H3,(H,14,16)
InChIKeyFUQSPESLZFEZDS-UHFFFAOYSA-N
MW255.32 g/mol
LogP-0.91
Rot. Bonds2

About 4-(3-aminocyclopentanecarbonyl)-N-methylmorpholine-3-carboxamide

4-(3-aminocyclopentanecarbonyl)-N-methylmorpholine-3-carboxamide (PubChem CID 83098008) has the molecular formula C12H21N3O3 and a molecular weight of 255.32 g/mol. Its IUPAC name is 4-(3-aminocyclopentanecarbonyl)-N-methylmorpholine-3-carboxamide.

Molecular Properties

Compound Name4-(3-aminocyclopentanecarbonyl)-N-methylmorpholine-3-carboxamide
PubChem CID83098008
Molecular FormulaC12H21N3O3
Molecular Weight255.32 g/mol
Exact Mass255.16
IUPAC Name4-(3-aminocyclopentanecarbonyl)-N-methylmorpholine-3-carboxamide
SMILESCNC(=O)C1COCCN1C(=O)C1CCC(N)C1
InChIInChI=1S/C12H21N3O3/c1-14-11(16)10-7-18-5-4-15(10)12(17)8-2-3-9(13)6-8/h8-10H,2-7,13H2,1H3,(H,14,16)
InChIKeyFUQSPESLZFEZDS-UHFFFAOYSA-N
XLogP-0.91
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 5-0.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-amino-3-methylcyclohexanecarbonyl)-N-methylmorpholine-3-carboxamide
CID 83104925
4-[4-(aminomethyl)cyclohexanecarbonyl]-N-methylmorpholine-3-carboxamide
CID 83099425
4-[3-(methylcarbamoyl)morpholine-4-carbonyl]cyclohexane-1-carboxylic acid
CID 83104998
4-(2-aminocycloheptanecarbonyl)-N-methylmorpholine-3-carboxamide
CID 83098853
4-[2-(3-aminocyclohexyl)propanoyl]-N-methylmorpholine-3-carboxamide
CID 106593033
4-[2-(4-aminopiperidin-1-yl)acetyl]-N-methylmorpholine-3-carboxamide
CID 83099577
(2R,5S)-5-[3-(methylcarbamoyl)morpholine-4-carbonyl]oxolane-2-carboxylic acid
CID 102945606
methyl 3-(methylcarbamoyl)morpholine-4-carboxylate
CID 116657428
4-(3-amino-4-methylcyclohexanecarbonyl)morpholine-3-carboxamide
CID 83095670
4-(2,2-dimethylpropanoyl)-N-methylmorpholine-3-carboxamide
CID 83105243
N-methyl-4-(3-oxobutanoyl)morpholine-3-carboxamide
CID 83097475
4-butanoyl-N-methylmorpholine-3-carboxamide
CID 83104060

Frequently Asked Questions

What is the IUPAC name of 4-(3-aminocyclopentanecarbonyl)-N-methylmorpholine-3-carboxamide?
The IUPAC name of 4-(3-aminocyclopentanecarbonyl)-N-methylmorpholine-3-carboxamide (CID 83098008) is 4-(3-aminocyclopentanecarbonyl)-N-methylmorpholine-3-carboxamide.
What is the SMILES notation for 4-(3-aminocyclopentanecarbonyl)-N-methylmorpholine-3-carboxamide?
The canonical SMILES for 4-(3-aminocyclopentanecarbonyl)-N-methylmorpholine-3-carboxamide is CNC(=O)C1COCCN1C(=O)C1CCC(N)C1.
What is the InChIKey of 4-(3-aminocyclopentanecarbonyl)-N-methylmorpholine-3-carboxamide?
The InChIKey is FUQSPESLZFEZDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O3/c1-14-11(16)10-7-18-5-4-15(10)12(17)8-2-3-9(13)6-8/h8-10H,2-7,13H2,1H3,(H,14,16).
What are the key properties of 4-(3-aminocyclopentanecarbonyl)-N-methylmorpholine-3-carboxamide?
4-(3-aminocyclopentanecarbonyl)-N-methylmorpholine-3-carboxamide has a molecular weight of 255.32 g/mol, XLogP of -0.91, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-aminocyclopentanecarbonyl)-N-methylmorpholine-3-carboxamide is sourced from PubChem (CID 83098008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).