1-morpholin-4-yl-2-[4-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)piperazin-1-yl]ethanone

C17H27N5O2 — CID 171993962

IUPAC1-morpholin-4-yl-2-[4-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)piperazin-1-yl]ethanone
SMILESO=C(CN1CCN(Cc2n[nH]c3c2CCC3)CC1)N1CCOCC1
InChIInChI=1S/C17H27N5O2/c23-17(22-8-10-24-11-9-22)13-21-6-4-20(5-7-21)12-16-14-2-1-3-15(14)18-19-16/h1-13H2,(H,18,19)
InChIKeyNQFSVJVWDYEJOB-UHFFFAOYSA-N
MW333.44 g/mol
LogP-0.13
Rot. Bonds4

About 1-morpholin-4-yl-2-[4-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)piperazin-1-yl]ethanone

1-morpholin-4-yl-2-[4-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)piperazin-1-yl]ethanone (PubChem CID 171993962) has the molecular formula C17H27N5O2 and a molecular weight of 333.44 g/mol. Its IUPAC name is 1-morpholin-4-yl-2-[4-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)piperazin-1-yl]ethanone.

Molecular Properties

Compound Name1-morpholin-4-yl-2-[4-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)piperazin-1-yl]ethanone
PubChem CID171993962
Molecular FormulaC17H27N5O2
Molecular Weight333.44 g/mol
Exact Mass333.22
IUPAC Name1-morpholin-4-yl-2-[4-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)piperazin-1-yl]ethanone
SMILESO=C(CN1CCN(Cc2n[nH]c3c2CCC3)CC1)N1CCOCC1
InChIInChI=1S/C17H27N5O2/c23-17(22-8-10-24-11-9-22)13-21-6-4-20(5-7-21)12-16-14-2-1-3-15(14)18-19-16/h1-13H2,(H,18,19)
InChIKeyNQFSVJVWDYEJOB-UHFFFAOYSA-N
XLogP-0.13
TPSA64.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.44
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-morpholin-4-yl-2-[4-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)piperazin-1-yl]ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-2-morpholin-4-yl-N-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-ylmethyl)acetamide
CID 91764997
5-{2-[rac-(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl}-3-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
CID 129624002
N-methyl-2-(2,2,3,3-tetrafluoropropoxy)-N-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-ylmethyl)acetamide
CID 91789242
4-[[1-(1,4,5,6-Tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)piperidin-4-yl]methyl]morpholine;bis(2,2,2-trifluoroacetic acid)
CID 171686767
3-ethyl-5-[2-(4-methylpiperazin-1-yl)propanoyl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
CID 121511779
[(2R,6S)-2,6-dimethylmorpholin-4-yl]-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-yl)methanone
CID 127758499
3-{[4-(4-Morpholinylmethyl)-1-piperidinyl]methyl}-1,4,5,6-tetrahydrocyclopenta[c]pyrazole bis(trifluoroacetate)
CID 28642170
1-isopropyl-N-methyl-N-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-ylmethyl)piperidine-4-carboxamide
CID 50979810
3-Hydroxy-1-(2-methoxyethyl)-3-{[methyl(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-ylmethyl)amino]methyl}piperidin-2-one
CID 56705753
1'-(cyclopropylcarbonyl)-N-(1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-ylmethyl)-1,4'-bipiperidine-3-carboxamide
CID 56871840
4-(2-{4-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propanoyl]piperazin-1-yl}ethyl)morpholine
CID 72883367
4-{1-[3-(4,5-dimethyl-1H-pyrazol-3-yl)propanoyl]-L-prolyl}morpholine
CID 74235337

Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-2-[4-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)piperazin-1-yl]ethanone?
The IUPAC name of 1-morpholin-4-yl-2-[4-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)piperazin-1-yl]ethanone (CID 171993962) is 1-morpholin-4-yl-2-[4-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)piperazin-1-yl]ethanone.
What is the SMILES notation for 1-morpholin-4-yl-2-[4-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)piperazin-1-yl]ethanone?
The canonical SMILES for 1-morpholin-4-yl-2-[4-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)piperazin-1-yl]ethanone is O=C(CN1CCN(Cc2n[nH]c3c2CCC3)CC1)N1CCOCC1.
What is the InChIKey of 1-morpholin-4-yl-2-[4-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)piperazin-1-yl]ethanone?
The InChIKey is NQFSVJVWDYEJOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N5O2/c23-17(22-8-10-24-11-9-22)13-21-6-4-20(5-7-21)12-16-14-2-1-3-15(14)18-19-16/h1-13H2,(H,18,19).
What are the key properties of 1-morpholin-4-yl-2-[4-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)piperazin-1-yl]ethanone?
1-morpholin-4-yl-2-[4-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)piperazin-1-yl]ethanone has a molecular weight of 333.44 g/mol, XLogP of -0.13, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-2-[4-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)piperazin-1-yl]ethanone is sourced from PubChem (CID 171993962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).