N,N-dimethyl-5-[(3S)-1-(5-propyl-1,2-oxazole-3-carbonyl)piperidin-3-yl]-1H-pyrazole-4-carboxamide

C18H25N5O3 — CID 124953653

IUPACN,N-dimethyl-5-[(3S)-1-(5-propyl-1,2-oxazole-3-carbonyl)piperidin-3-yl]-1H-pyrazole-4-carboxamide
SMILESCCCc1cc(C(=O)N2CCC[C@H](c3[nH]ncc3C(=O)N(C)C)C2)no1
InChIInChI=1S/C18H25N5O3/c1-4-6-13-9-15(21-26-13)18(25)23-8-5-7-12(11-23)16-14(10-19-20-16)17(24)22(2)3/h9-10,12H,4-8,11H2,1-3H3,(H,19,20)/t12-/m0/s1
InChIKeyDWPMWQRPNQMYBZ-LBPRGKRZSA-N
MW359.43 g/mol
LogP2.07
Rot. Bonds5

About N,N-dimethyl-5-[(3S)-1-(5-propyl-1,2-oxazole-3-carbonyl)piperidin-3-yl]-1H-pyrazole-4-carboxamide

N,N-dimethyl-5-[(3S)-1-(5-propyl-1,2-oxazole-3-carbonyl)piperidin-3-yl]-1H-pyrazole-4-carboxamide (PubChem CID 124953653) has the molecular formula C18H25N5O3 and a molecular weight of 359.43 g/mol. Its IUPAC name is N,N-dimethyl-5-[(3S)-1-(5-propyl-1,2-oxazole-3-carbonyl)piperidin-3-yl]-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-5-[(3S)-1-(5-propyl-1,2-oxazole-3-carbonyl)piperidin-3-yl]-1H-pyrazole-4-carboxamide
PubChem CID124953653
Molecular FormulaC18H25N5O3
Molecular Weight359.43 g/mol
Exact Mass359.20
IUPAC NameN,N-dimethyl-5-[(3S)-1-(5-propyl-1,2-oxazole-3-carbonyl)piperidin-3-yl]-1H-pyrazole-4-carboxamide
SMILESCCCc1cc(C(=O)N2CCC[C@H](c3[nH]ncc3C(=O)N(C)C)C2)no1
InChIInChI=1S/C18H25N5O3/c1-4-6-13-9-15(21-26-13)18(25)23-8-5-7-12(11-23)16-14(10-19-20-16)17(24)22(2)3/h9-10,12H,4-8,11H2,1-3H3,(H,19,20)/t12-/m0/s1
InChIKeyDWPMWQRPNQMYBZ-LBPRGKRZSA-N
XLogP2.07
TPSA95.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N,N-dimethyl-5-[(3S)-1-(5-propyl-1,2-oxazole-3-carbonyl)piperidin-3-yl]-1H-pyrazole-4-carboxamide with MolForge

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Related Compounds

(5-propyl-1,2-oxazol-3-yl)-[3-(1H-pyrazolo[5,4-b]pyridin-6-yl)piperidin-1-yl]methanone
CID 110118698
5-[(3R)-1-(3-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carbonyl)piperidin-3-yl]-N,N-dimethyl-1H-pyrazole-4-carboxamide
CID 129324033
[2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-(5-propyl-1,2-oxazol-3-yl)methanone
CID 127247312
5-[1-(1-ethylpyrazole-3-carbonyl)piperidin-3-yl]-N-methyl-N-phenyl-1H-pyrazole-4-carboxamide
CID 110083029
(5-propyl-1,2-oxazol-3-yl)-[(3S)-3-(pyridin-3-ylmethyl)piperidin-1-yl]methanone
CID 124986927
3-[4-(dimethylcarbamoyl)-1H-pyrazol-5-yl]-N-[2-(1H-indol-3-yl)ethyl]piperidine-1-carboxamide
CID 128998937
(4-methylpiperidin-1-yl)-(5-propyl-1,2-oxazol-3-yl)methanone
CID 22427573
N-cyclohexyl-N-methyl-5-[1-(1-propylpyrazole-4-carbonyl)piperidin-3-yl]-1H-pyrazole-4-carboxamide
CID 110083035
N-cyclohexyl-N-methyl-5-[(3S)-1-(1-propylpyrazole-4-carbonyl)piperidin-3-yl]-1H-pyrazole-4-carboxamide
CID 125008854
[(3S,4S)-3,4-bis(hydroxymethyl)pyrrolidin-1-yl]-(5-propyl-1,2-oxazol-3-yl)methanone
CID 70728444
[(3S)-3-[5-(imidazol-1-ylmethyl)-4-methyl-1,2,4-triazol-3-yl]piperidin-1-yl]-(5-propyl-1,2-oxazol-3-yl)methanone
CID 97197120
morpholin-4-yl-(5-propyl-1,2-oxazol-3-yl)methanone
CID 46246353

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-5-[(3S)-1-(5-propyl-1,2-oxazole-3-carbonyl)piperidin-3-yl]-1H-pyrazole-4-carboxamide?
The IUPAC name of N,N-dimethyl-5-[(3S)-1-(5-propyl-1,2-oxazole-3-carbonyl)piperidin-3-yl]-1H-pyrazole-4-carboxamide (CID 124953653) is N,N-dimethyl-5-[(3S)-1-(5-propyl-1,2-oxazole-3-carbonyl)piperidin-3-yl]-1H-pyrazole-4-carboxamide.
What is the SMILES notation for N,N-dimethyl-5-[(3S)-1-(5-propyl-1,2-oxazole-3-carbonyl)piperidin-3-yl]-1H-pyrazole-4-carboxamide?
The canonical SMILES for N,N-dimethyl-5-[(3S)-1-(5-propyl-1,2-oxazole-3-carbonyl)piperidin-3-yl]-1H-pyrazole-4-carboxamide is CCCc1cc(C(=O)N2CCC[C@H](c3[nH]ncc3C(=O)N(C)C)C2)no1.
What is the InChIKey of N,N-dimethyl-5-[(3S)-1-(5-propyl-1,2-oxazole-3-carbonyl)piperidin-3-yl]-1H-pyrazole-4-carboxamide?
The InChIKey is DWPMWQRPNQMYBZ-LBPRGKRZSA-N. The full InChI is InChI=1S/C18H25N5O3/c1-4-6-13-9-15(21-26-13)18(25)23-8-5-7-12(11-23)16-14(10-19-20-16)17(24)22(2)3/h9-10,12H,4-8,11H2,1-3H3,(H,19,20)/t12-/m0/s1.
What are the key properties of N,N-dimethyl-5-[(3S)-1-(5-propyl-1,2-oxazole-3-carbonyl)piperidin-3-yl]-1H-pyrazole-4-carboxamide?
N,N-dimethyl-5-[(3S)-1-(5-propyl-1,2-oxazole-3-carbonyl)piperidin-3-yl]-1H-pyrazole-4-carboxamide has a molecular weight of 359.43 g/mol, XLogP of 2.07, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-5-[(3S)-1-(5-propyl-1,2-oxazole-3-carbonyl)piperidin-3-yl]-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 124953653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).