N-[4-(4-hydroxypiperidine-1-carbonyl)-1,3-oxazol-2-yl]cyclopropanecarboxamide

C13H17N3O4 — CID 121110480

IUPACN-[4-(4-hydroxypiperidine-1-carbonyl)-1,3-oxazol-2-yl]cyclopropanecarboxamide
SMILESO=C(Nc1nc(C(=O)N2CCC(O)CC2)co1)C1CC1
InChIInChI=1S/C13H17N3O4/c17-9-3-5-16(6-4-9)12(19)10-7-20-13(14-10)15-11(18)8-1-2-8/h7-9,17H,1-6H2,(H,14,15,18)
InChIKeyTWIZPPQRRBJIFP-UHFFFAOYSA-N
MW279.30 g/mol
LogP0.62
Rot. Bonds3

About N-[4-(4-hydroxypiperidine-1-carbonyl)-1,3-oxazol-2-yl]cyclopropanecarboxamide

N-[4-(4-hydroxypiperidine-1-carbonyl)-1,3-oxazol-2-yl]cyclopropanecarboxamide (PubChem CID 121110480) has the molecular formula C13H17N3O4 and a molecular weight of 279.30 g/mol. Its IUPAC name is N-[4-(4-hydroxypiperidine-1-carbonyl)-1,3-oxazol-2-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[4-(4-hydroxypiperidine-1-carbonyl)-1,3-oxazol-2-yl]cyclopropanecarboxamide
PubChem CID121110480
Molecular FormulaC13H17N3O4
Molecular Weight279.30 g/mol
Exact Mass279.12
IUPAC NameN-[4-(4-hydroxypiperidine-1-carbonyl)-1,3-oxazol-2-yl]cyclopropanecarboxamide
SMILESO=C(Nc1nc(C(=O)N2CCC(O)CC2)co1)C1CC1
InChIInChI=1S/C13H17N3O4/c17-9-3-5-16(6-4-9)12(19)10-7-20-13(14-10)15-11(18)8-1-2-8/h7-9,17H,1-6H2,(H,14,15,18)
InChIKeyTWIZPPQRRBJIFP-UHFFFAOYSA-N
XLogP0.62
TPSA95.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]cyclopropanecarboxamide
CID 121110475
N-[4-(4-benzylpiperidine-1-carbonyl)-1,3-oxazol-2-yl]cyclopropanecarboxamide
CID 56765140
N-[4-[4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbonyl]-1,3-oxazol-2-yl]cyclopropanecarboxamide
CID 121110608
2-(cyclopropanecarbonylamino)-N-methoxy-1,3-oxazole-4-carboxamide
CID 56765163
N-(4-acetylphenyl)-2-(cyclopropanecarbonylamino)-1,3-oxazole-4-carboxamide
CID 121110555
2-(cyclopropanecarbonylamino)-N-(4-methyl-1,3-thiazol-2-yl)-1,3-oxazole-4-carboxamide
CID 71788416
N-(2-carbamoylphenyl)-2-(cyclopropanecarbonylamino)-1,3-oxazole-4-carboxamide
CID 121110560
N-(4-phenyl-1,3-oxazol-2-yl)-1-(pyrrolidine-1-carbonyl)piperidine-4-carboxamide
CID 132972292
N-[4-(4-cyclohexylpiperazine-1-carbonyl)-1,3-oxazol-2-yl]benzamide
CID 90515048
ethyl 1-[2-(methylaminomethyl)-1,3-oxazole-4-carbonyl]piperidine-4-carboxylate
CID 3863538
N-(4-phenyl-1,3-oxazol-2-yl)-1-prop-2-enoylpiperidine-4-carboxamide
CID 166417069
N-[4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-1,3-oxazol-2-yl]benzamide
CID 90514908

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-hydroxypiperidine-1-carbonyl)-1,3-oxazol-2-yl]cyclopropanecarboxamide?
The IUPAC name of N-[4-(4-hydroxypiperidine-1-carbonyl)-1,3-oxazol-2-yl]cyclopropanecarboxamide (CID 121110480) is N-[4-(4-hydroxypiperidine-1-carbonyl)-1,3-oxazol-2-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[4-(4-hydroxypiperidine-1-carbonyl)-1,3-oxazol-2-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[4-(4-hydroxypiperidine-1-carbonyl)-1,3-oxazol-2-yl]cyclopropanecarboxamide is O=C(Nc1nc(C(=O)N2CCC(O)CC2)co1)C1CC1.
What is the InChIKey of N-[4-(4-hydroxypiperidine-1-carbonyl)-1,3-oxazol-2-yl]cyclopropanecarboxamide?
The InChIKey is TWIZPPQRRBJIFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O4/c17-9-3-5-16(6-4-9)12(19)10-7-20-13(14-10)15-11(18)8-1-2-8/h7-9,17H,1-6H2,(H,14,15,18).
What are the key properties of N-[4-(4-hydroxypiperidine-1-carbonyl)-1,3-oxazol-2-yl]cyclopropanecarboxamide?
N-[4-(4-hydroxypiperidine-1-carbonyl)-1,3-oxazol-2-yl]cyclopropanecarboxamide has a molecular weight of 279.30 g/mol, XLogP of 0.62, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-hydroxypiperidine-1-carbonyl)-1,3-oxazol-2-yl]cyclopropanecarboxamide is sourced from PubChem (CID 121110480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).