N-morpholin-4-yl-3-propylpyrrolidine-3-carboxamide

C12H23N3O2 — CID 83016950

IUPACN-morpholin-4-yl-3-propylpyrrolidine-3-carboxamide
SMILESCCCC1(C(=O)NN2CCOCC2)CCNC1
InChIInChI=1S/C12H23N3O2/c1-2-3-12(4-5-13-10-12)11(16)14-15-6-8-17-9-7-15/h13H,2-10H2,1H3,(H,14,16)
InChIKeyVEHKVGYRBDYKAK-UHFFFAOYSA-N
MW241.33 g/mol
LogP0.13
Rot. Bonds4

About N-morpholin-4-yl-3-propylpyrrolidine-3-carboxamide

N-morpholin-4-yl-3-propylpyrrolidine-3-carboxamide (PubChem CID 83016950) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is N-morpholin-4-yl-3-propylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-morpholin-4-yl-3-propylpyrrolidine-3-carboxamide
PubChem CID83016950
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC NameN-morpholin-4-yl-3-propylpyrrolidine-3-carboxamide
SMILESCCCC1(C(=O)NN2CCOCC2)CCNC1
InChIInChI=1S/C12H23N3O2/c1-2-3-12(4-5-13-10-12)11(16)14-15-6-8-17-9-7-15/h13H,2-10H2,1H3,(H,14,16)
InChIKeyVEHKVGYRBDYKAK-UHFFFAOYSA-N
XLogP0.13
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 50.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-ethyl-N-morpholin-4-ylpiperidine-3-carboxamide
CID 83015753
N-morpholin-4-yl-3-propan-2-ylpyrrolidine-3-carboxamide
CID 106981151
N-(1,2,4-oxadiazol-3-ylmethyl)-3-propylpyrrolidine-3-carboxamide
CID 106396912
3-ethyl-N-(1-morpholin-4-ylpropan-2-yl)pyrrolidine-3-carboxamide
CID 63139450
piperazin-1-yl-(3-propylpyrrolidin-3-yl)methanone
CID 63139032
N-cyclopentyl-3-propylpyrrolidine-3-carboxamide
CID 63141137
N-cyclobutyl-3-propylpyrrolidine-3-carboxamide
CID 63142561
2-[(3-propylpyrrolidine-3-carbonyl)amino]butanoic acid
CID 55166881
N-[3-(4-methylpiperazin-1-yl)propyl]-3-propylpyrrolidine-3-carboxamide
CID 63141437
N-(3-methyl-2-pyrrolidin-1-ylbutyl)-3-propylpyrrolidine-3-carboxamide
CID 63141311
3-(2-morpholin-4-ylethyl)pyrrolidine-3-carboxylic acid
CID 79425835
N-methyl-N-(oxan-4-ylmethyl)-3-propylpyrrolidine-3-carboxamide
CID 55226836

Frequently Asked Questions

What is the IUPAC name of N-morpholin-4-yl-3-propylpyrrolidine-3-carboxamide?
The IUPAC name of N-morpholin-4-yl-3-propylpyrrolidine-3-carboxamide (CID 83016950) is N-morpholin-4-yl-3-propylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-morpholin-4-yl-3-propylpyrrolidine-3-carboxamide?
The canonical SMILES for N-morpholin-4-yl-3-propylpyrrolidine-3-carboxamide is CCCC1(C(=O)NN2CCOCC2)CCNC1.
What is the InChIKey of N-morpholin-4-yl-3-propylpyrrolidine-3-carboxamide?
The InChIKey is VEHKVGYRBDYKAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-2-3-12(4-5-13-10-12)11(16)14-15-6-8-17-9-7-15/h13H,2-10H2,1H3,(H,14,16).
What are the key properties of N-morpholin-4-yl-3-propylpyrrolidine-3-carboxamide?
N-morpholin-4-yl-3-propylpyrrolidine-3-carboxamide has a molecular weight of 241.33 g/mol, XLogP of 0.13, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-morpholin-4-yl-3-propylpyrrolidine-3-carboxamide is sourced from PubChem (CID 83016950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).