4-[[5-[1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidin-3-yl]-1H-pyrazol-4-yl]methyl]morpholine

C19H30N6O2 — CID 167884798

IUPAC4-[[5-[1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidin-3-yl]-1H-pyrazol-4-yl]methyl]morpholine
SMILESCc1noc(CCCN2CCCC(c3[nH]ncc3CN3CCOCC3)C2)n1
InChIInChI=1S/C19H30N6O2/c1-15-21-18(27-23-15)5-3-7-24-6-2-4-16(13-24)19-17(12-20-22-19)14-25-8-10-26-11-9-25/h12,16H,2-11,13-14H2,1H3,(H,20,22)
InChIKeyQQKSAMDPFBKYCL-UHFFFAOYSA-N
MW374.49 g/mol
LogP1.75
Rot. Bonds7

About 4-[[5-[1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidin-3-yl]-1H-pyrazol-4-yl]methyl]morpholine

4-[[5-[1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidin-3-yl]-1H-pyrazol-4-yl]methyl]morpholine (PubChem CID 167884798) has the molecular formula C19H30N6O2 and a molecular weight of 374.49 g/mol. Its IUPAC name is 4-[[5-[1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidin-3-yl]-1H-pyrazol-4-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[5-[1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidin-3-yl]-1H-pyrazol-4-yl]methyl]morpholine
PubChem CID167884798
Molecular FormulaC19H30N6O2
Molecular Weight374.49 g/mol
Exact Mass374.24
IUPAC Name4-[[5-[1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidin-3-yl]-1H-pyrazol-4-yl]methyl]morpholine
SMILESCc1noc(CCCN2CCCC(c3[nH]ncc3CN3CCOCC3)C2)n1
InChIInChI=1S/C19H30N6O2/c1-15-21-18(27-23-15)5-3-7-24-6-2-4-16(13-24)19-17(12-20-22-19)14-25-8-10-26-11-9-25/h12,16H,2-11,13-14H2,1H3,(H,20,22)
InChIKeyQQKSAMDPFBKYCL-UHFFFAOYSA-N
XLogP1.75
TPSA83.31 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.49
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-[[5-[(3S)-1-[3-(2-methylimidazol-1-yl)propyl]piperidin-3-yl]-1H-pyrazol-4-yl]methyl]morpholine
CID 129474874
4-[[5-[1-(1,2-oxazol-5-ylmethyl)piperidin-3-yl]-1H-pyrazol-4-yl]methyl]morpholine
CID 154740983
4-[[5-[(3S)-1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperidin-3-yl]-1H-pyrazol-4-yl]methyl]morpholine
CID 129477125
4-[3-[4-(morpholin-4-ylmethyl)-1H-pyrazol-5-yl]piperidin-1-yl]benzonitrile
CID 154736088
4-[[5-[1-[4-(trifluoromethyl)pyrimidin-2-yl]piperidin-3-yl]-1H-pyrazol-4-yl]methyl]morpholine
CID 128974960
4-[[4-methyl-5-[(3S)-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-3-yl]-1,2,4-triazol-3-yl]methyl]morpholine
CID 95885484
4-[[5-[(3R)-1-(8-methylquinazolin-4-yl)piperidin-3-yl]-1H-pyrazol-4-yl]methyl]morpholine
CID 129336500
5-fluoro-2-[(3S)-3-[4-(morpholin-4-ylmethyl)-1H-pyrazol-5-yl]piperidin-1-yl]-1,3-benzoxazole
CID 129476423
2-(5-methoxy-2-pyridinyl)-1-[3-[4-(morpholin-4-ylmethyl)-1H-pyrazol-5-yl]piperidin-1-yl]ethanone
CID 126804542
1-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]piperidin-3-amine
CID 106421375
2-[(3R)-3-[4-(morpholin-4-ylmethyl)-1H-pyrazol-5-yl]piperidin-1-yl]-N-(pyridin-3-ylmethyl)acetamide
CID 129477557
(3-ethoxy-2-pyridinyl)-[3-[4-(morpholin-4-ylmethyl)-1H-pyrazol-5-yl]piperidin-1-yl]methanone
CID 126817567

Frequently Asked Questions

What is the IUPAC name of 4-[[5-[1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidin-3-yl]-1H-pyrazol-4-yl]methyl]morpholine?
The IUPAC name of 4-[[5-[1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidin-3-yl]-1H-pyrazol-4-yl]methyl]morpholine (CID 167884798) is 4-[[5-[1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidin-3-yl]-1H-pyrazol-4-yl]methyl]morpholine.
What is the SMILES notation for 4-[[5-[1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidin-3-yl]-1H-pyrazol-4-yl]methyl]morpholine?
The canonical SMILES for 4-[[5-[1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidin-3-yl]-1H-pyrazol-4-yl]methyl]morpholine is Cc1noc(CCCN2CCCC(c3[nH]ncc3CN3CCOCC3)C2)n1.
What is the InChIKey of 4-[[5-[1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidin-3-yl]-1H-pyrazol-4-yl]methyl]morpholine?
The InChIKey is QQKSAMDPFBKYCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N6O2/c1-15-21-18(27-23-15)5-3-7-24-6-2-4-16(13-24)19-17(12-20-22-19)14-25-8-10-26-11-9-25/h12,16H,2-11,13-14H2,1H3,(H,20,22).
What are the key properties of 4-[[5-[1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidin-3-yl]-1H-pyrazol-4-yl]methyl]morpholine?
4-[[5-[1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidin-3-yl]-1H-pyrazol-4-yl]methyl]morpholine has a molecular weight of 374.49 g/mol, XLogP of 1.75, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[5-[1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidin-3-yl]-1H-pyrazol-4-yl]methyl]morpholine is sourced from PubChem (CID 167884798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).