1-[(3R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]piperidine-3-carboxamide

C15H25N5O2 — CID 168832159

IUPAC1-[(3R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]piperidine-3-carboxamide
SMILESCC(C)c1noc(N2CC[C@@H](N3CCCC(C(N)=O)C3)C2)n1
InChIInChI=1S/C15H25N5O2/c1-10(2)14-17-15(22-18-14)20-7-5-12(9-20)19-6-3-4-11(8-19)13(16)21/h10-12H,3-9H2,1-2H3,(H2,16,21)/t11?,12-/m1/s1
InChIKeyMQNHALQTJNYVGN-PIJUOVFKSA-N
MW307.40 g/mol
LogP0.97
Rot. Bonds4

About 1-[(3R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]piperidine-3-carboxamide

1-[(3R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]piperidine-3-carboxamide (PubChem CID 168832159) has the molecular formula C15H25N5O2 and a molecular weight of 307.40 g/mol. Its IUPAC name is 1-[(3R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]piperidine-3-carboxamide.

Molecular Properties

Compound Name1-[(3R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]piperidine-3-carboxamide
PubChem CID168832159
Molecular FormulaC15H25N5O2
Molecular Weight307.40 g/mol
Exact Mass307.20
IUPAC Name1-[(3R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]piperidine-3-carboxamide
SMILESCC(C)c1noc(N2CC[C@@H](N3CCCC(C(N)=O)C3)C2)n1
InChIInChI=1S/C15H25N5O2/c1-10(2)14-17-15(22-18-14)20-7-5-12(9-20)19-6-3-4-11(8-19)13(16)21/h10-12H,3-9H2,1-2H3,(H2,16,21)/t11?,12-/m1/s1
InChIKeyMQNHALQTJNYVGN-PIJUOVFKSA-N
XLogP0.97
TPSA88.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.40
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-[(3R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]piperidine-3-carboxamide with MolForge

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Related Compounds

cyclohex-3-ene-1-carboxamide;5-piperidin-1-yl-3-propan-2-yl-1,2,4-oxadiazole
CID 160610393
5-(4-cyclopropylpiperidin-1-yl)-3-propan-2-yl-1,2,4-oxadiazole
CID 70856291
1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidine-4-carbaldehyde
CID 86638744
(3S)-N-cyclopropyl-1-[1-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]piperidine-3-carboxamide
CID 95503021
1-cyclopentyl-N-[2-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]piperidine-3-carboxamide
CID 72879168
(3S)-1-(1-propylpiperidin-4-yl)piperidine-3-carboxamide
CID 30982597
3-propan-2-yl-5-(4-propylpiperidin-1-yl)-1,2,4-oxadiazole
CID 67212517
3-[1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidin-4-yl]propan-1-amine
CID 68571697
N-cyclopropyl-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidine-2-carboxamide
CID 86805159
1-(4-oxocyclohexyl)piperidine-3-carboxamide
CID 114761991
1-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]piperidine-3-carboxamide
CID 80975607
5-[3-(2,6-difluorophenyl)pyrrolidin-1-yl]-3-propan-2-yl-1,2,4-oxadiazole
CID 133480686

Frequently Asked Questions

What is the IUPAC name of 1-[(3R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]piperidine-3-carboxamide?
The IUPAC name of 1-[(3R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]piperidine-3-carboxamide (CID 168832159) is 1-[(3R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]piperidine-3-carboxamide.
What is the SMILES notation for 1-[(3R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]piperidine-3-carboxamide?
The canonical SMILES for 1-[(3R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]piperidine-3-carboxamide is CC(C)c1noc(N2CC[C@@H](N3CCCC(C(N)=O)C3)C2)n1.
What is the InChIKey of 1-[(3R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]piperidine-3-carboxamide?
The InChIKey is MQNHALQTJNYVGN-PIJUOVFKSA-N. The full InChI is InChI=1S/C15H25N5O2/c1-10(2)14-17-15(22-18-14)20-7-5-12(9-20)19-6-3-4-11(8-19)13(16)21/h10-12H,3-9H2,1-2H3,(H2,16,21)/t11?,12-/m1/s1.
What are the key properties of 1-[(3R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]piperidine-3-carboxamide?
1-[(3R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]piperidine-3-carboxamide has a molecular weight of 307.40 g/mol, XLogP of 0.97, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-yl]piperidine-3-carboxamide is sourced from PubChem (CID 168832159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).