N-cyclopropyl-4-[2-(methylamino)propanoyl]morpholine-3-carboxamide

C12H21N3O3 — CID 83097661

IUPACN-cyclopropyl-4-[2-(methylamino)propanoyl]morpholine-3-carboxamide
SMILESCNC(C)C(=O)N1CCOCC1C(=O)NC1CC1
InChIInChI=1S/C12H21N3O3/c1-8(13-2)12(17)15-5-6-18-7-10(15)11(16)14-9-3-4-9/h8-10,13H,3-7H2,1-2H3,(H,14,16)
InChIKeyQYFDZXOWGCJNIS-UHFFFAOYSA-N
MW255.32 g/mol
LogP-0.90
Rot. Bonds4

About N-cyclopropyl-4-[2-(methylamino)propanoyl]morpholine-3-carboxamide

N-cyclopropyl-4-[2-(methylamino)propanoyl]morpholine-3-carboxamide (PubChem CID 83097661) has the molecular formula C12H21N3O3 and a molecular weight of 255.32 g/mol. Its IUPAC name is N-cyclopropyl-4-[2-(methylamino)propanoyl]morpholine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-4-[2-(methylamino)propanoyl]morpholine-3-carboxamide
PubChem CID83097661
Molecular FormulaC12H21N3O3
Molecular Weight255.32 g/mol
Exact Mass255.16
IUPAC NameN-cyclopropyl-4-[2-(methylamino)propanoyl]morpholine-3-carboxamide
SMILESCNC(C)C(=O)N1CCOCC1C(=O)NC1CC1
InChIInChI=1S/C12H21N3O3/c1-8(13-2)12(17)15-5-6-18-7-10(15)11(16)14-9-3-4-9/h8-10,13H,3-7H2,1-2H3,(H,14,16)
InChIKeyQYFDZXOWGCJNIS-UHFFFAOYSA-N
XLogP-0.90
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 5-0.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-bromo-3-methylbutanoyl)-N-cyclopropylmorpholine-3-carboxamide
CID 83106807
3-N-cyclopropyl-4-N-methylmorpholine-3,4-dicarboxamide
CID 116657472
4-[(2R)-2-amino-4-methylpentanoyl]-N-cyclopropylmorpholine-3-carboxamide
CID 104903912
4-[2-(methylamino)propanoyl]-N-propylmorpholine-3-carboxamide
CID 83097059
4-(2-amino-3-methylpentanoyl)-N-cyclopropylmorpholine-3-carboxamide
CID 83098233
N-cyclopropyl-4-(2,2-dimethylpropanoyl)morpholine-3-carboxamide
CID 83104501
4-N-(2-chloropropanoyl)-3-N-cyclopropylmorpholine-3,4-dicarboxamide
CID 83103615
4-(4-aminopentanoyl)-N-cyclopropylmorpholine-3-carboxamide
CID 83096865
5-[3-(cyclopropylcarbamoyl)morpholin-4-yl]-3-methyl-5-oxopentanoic acid
CID 83098608
N-cyclopropyl-4-(2-sulfanylacetyl)morpholine-3-carboxamide
CID 83105257
4-(5-aminohexanoyl)-N-cyclopropylmorpholine-3-carboxamide
CID 83098457
N-cyclopropyl-4-(2-hydrazinyl-2-oxoacetyl)morpholine-3-carboxamide
CID 83103627

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-[2-(methylamino)propanoyl]morpholine-3-carboxamide?
The IUPAC name of N-cyclopropyl-4-[2-(methylamino)propanoyl]morpholine-3-carboxamide (CID 83097661) is N-cyclopropyl-4-[2-(methylamino)propanoyl]morpholine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-4-[2-(methylamino)propanoyl]morpholine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-4-[2-(methylamino)propanoyl]morpholine-3-carboxamide is CNC(C)C(=O)N1CCOCC1C(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-4-[2-(methylamino)propanoyl]morpholine-3-carboxamide?
The InChIKey is QYFDZXOWGCJNIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O3/c1-8(13-2)12(17)15-5-6-18-7-10(15)11(16)14-9-3-4-9/h8-10,13H,3-7H2,1-2H3,(H,14,16).
What are the key properties of N-cyclopropyl-4-[2-(methylamino)propanoyl]morpholine-3-carboxamide?
N-cyclopropyl-4-[2-(methylamino)propanoyl]morpholine-3-carboxamide has a molecular weight of 255.32 g/mol, XLogP of -0.90, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-[2-(methylamino)propanoyl]morpholine-3-carboxamide is sourced from PubChem (CID 83097661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).