5-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-oxazole-4-carboxamide;hydrochloride

C12H20ClN3O2 — CID 119532219

IUPAC5-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-oxazole-4-carboxamide;hydrochloride
SMILESCCCN(C(=O)c1ncoc1C)C1CCNC1.Cl
InChIInChI=1S/C12H19N3O2.ClH/c1-3-6-15(10-4-5-13-7-10)12(16)11-9(2)17-8-14-11;/h8,10,13H,3-7H2,1-2H3;1H
InChIKeyXLNNVCJIWCJWDV-UHFFFAOYSA-N
MW273.76 g/mol
LogP1.62
Rot. Bonds4

About 5-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-oxazole-4-carboxamide;hydrochloride

5-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-oxazole-4-carboxamide;hydrochloride (PubChem CID 119532219) has the molecular formula C12H20ClN3O2 and a molecular weight of 273.76 g/mol. Its IUPAC name is 5-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-oxazole-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name5-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-oxazole-4-carboxamide;hydrochloride
PubChem CID119532219
Molecular FormulaC12H20ClN3O2
Molecular Weight273.76 g/mol
Exact Mass273.12
IUPAC Name5-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-oxazole-4-carboxamide;hydrochloride
SMILESCCCN(C(=O)c1ncoc1C)C1CCNC1.Cl
InChIInChI=1S/C12H19N3O2.ClH/c1-3-6-15(10-4-5-13-7-10)12(16)11-9(2)17-8-14-11;/h8,10,13H,3-7H2,1-2H3;1H
InChIKeyXLNNVCJIWCJWDV-UHFFFAOYSA-N
XLogP1.62
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.76
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-N-piperidin-4-yl-N-propyl-1,3-oxazole-4-carboxamide
CID 119825428
2-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-thiazole-5-carboxamide;hydrochloride
CID 119533138
2,4-dimethyl-N-propyl-N-pyrrolidin-3-yl-1,3-oxazole-5-carboxamide;hydrochloride
CID 119532322
N-propyl-N-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine-2-carboxamide
CID 115737122
2-methyl-N-propyl-N-pyrrolidin-3-ylpyridine-4-carboxamide
CID 106753627
2,4-dimethyl-N-propyl-N-[(3R)-pyrrolidin-3-yl]-1,3-oxazole-5-carboxamide
CID 124574512
5-bromo-N-propyl-N-pyrrolidin-3-ylpyridine-2-carboxamide;dihydrochloride
CID 119531290
2-(furan-2-yl)-5-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-thiazole-4-carboxamide
CID 119530777
4-bromo-N-propyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119532826
N,2-dipropyl-N-pyrrolidin-3-yl-1,3-thiazole-5-carboxamide
CID 119533233
N-propyl-N-pyrrolidin-3-ylquinoxaline-2-carboxamide
CID 103806535
5-chloro-2-propan-2-yl-N-propyl-N-pyrrolidin-3-ylpyrimidine-4-carboxamide
CID 119530022

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-oxazole-4-carboxamide;hydrochloride?
The IUPAC name of 5-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-oxazole-4-carboxamide;hydrochloride (CID 119532219) is 5-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-oxazole-4-carboxamide;hydrochloride.
What is the SMILES notation for 5-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-oxazole-4-carboxamide;hydrochloride?
The canonical SMILES for 5-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-oxazole-4-carboxamide;hydrochloride is CCCN(C(=O)c1ncoc1C)C1CCNC1.Cl.
What is the InChIKey of 5-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-oxazole-4-carboxamide;hydrochloride?
The InChIKey is XLNNVCJIWCJWDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2.ClH/c1-3-6-15(10-4-5-13-7-10)12(16)11-9(2)17-8-14-11;/h8,10,13H,3-7H2,1-2H3;1H.
What are the key properties of 5-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-oxazole-4-carboxamide;hydrochloride?
5-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-oxazole-4-carboxamide;hydrochloride has a molecular weight of 273.76 g/mol, XLogP of 1.62, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-oxazole-4-carboxamide;hydrochloride is sourced from PubChem (CID 119532219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).