4-[(3R)-1-[(4-cyclopentyloxyphenyl)methyl]piperidin-3-yl]morpholine

C21H32N2O2 — CID 92641147

IUPAC4-[(3R)-1-[(4-cyclopentyloxyphenyl)methyl]piperidin-3-yl]morpholine
SMILESc1cc(OC2CCCC2)ccc1CN1CCC[C@@H](N2CCOCC2)C1
InChIInChI=1S/C21H32N2O2/c1-2-6-20(5-1)25-21-9-7-18(8-10-21)16-22-11-3-4-19(17-22)23-12-14-24-15-13-23/h7-10,19-20H,1-6,11-17H2/t19-/m1/s1
InChIKeyZTWVNFUJGGIVHQ-LJQANCHMSA-N
MW344.50 g/mol
LogP3.30
Rot. Bonds5

About 4-[(3R)-1-[(4-cyclopentyloxyphenyl)methyl]piperidin-3-yl]morpholine

4-[(3R)-1-[(4-cyclopentyloxyphenyl)methyl]piperidin-3-yl]morpholine (PubChem CID 92641147) has the molecular formula C21H32N2O2 and a molecular weight of 344.50 g/mol. Its IUPAC name is 4-[(3R)-1-[(4-cyclopentyloxyphenyl)methyl]piperidin-3-yl]morpholine.

Molecular Properties

Compound Name4-[(3R)-1-[(4-cyclopentyloxyphenyl)methyl]piperidin-3-yl]morpholine
PubChem CID92641147
Molecular FormulaC21H32N2O2
Molecular Weight344.50 g/mol
Exact Mass344.25
IUPAC Name4-[(3R)-1-[(4-cyclopentyloxyphenyl)methyl]piperidin-3-yl]morpholine
SMILESc1cc(OC2CCCC2)ccc1CN1CCC[C@@H](N2CCOCC2)C1
InChIInChI=1S/C21H32N2O2/c1-2-6-20(5-1)25-21-9-7-18(8-10-21)16-22-11-3-4-19(17-22)23-12-14-24-15-13-23/h7-10,19-20H,1-6,11-17H2/t19-/m1/s1
InChIKeyZTWVNFUJGGIVHQ-LJQANCHMSA-N
XLogP3.30
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.50
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(3R,4R)-1-[(4-cyclopentyloxyphenyl)methyl]-4-morpholin-4-ylpiperidin-3-ol
CID 31015761
(3S,4S)-1-[(4-cyclopentyloxyphenyl)methyl]-4-morpholin-4-ylpyrrolidin-3-ol
CID 56854894
4-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-ylmethyl)aniline
CID 63149912
4-[1-[(3-methylphenyl)methyl]piperidin-3-yl]morpholine
CID 172905640
(9aS)-2-[[4-(difluoromethoxy)phenyl]methyl]-1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepine
CID 124839933
(3R)-1-[(4-phenylmethoxyphenyl)methyl]-3-pyrrolidin-1-ylpiperidine
CID 28784062
4-[1-[(2-fluorophenyl)methyl]piperidin-3-yl]morpholine
CID 172905616
2-[(4-methylphenyl)methyl]-3,4,5,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a][1,4]diazepine
CID 79926733
2-chloro-4-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]phenol
CID 82979175
4-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]benzenecarbothioamide
CID 63169493
1-[(4-cyclopentyloxyphenyl)methyl]-4-methylsulfonyl-1,4-diazepane
CID 91773142
2-(pyridin-4-ylmethyl)-1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepine
CID 79006212

Frequently Asked Questions

What is the IUPAC name of 4-[(3R)-1-[(4-cyclopentyloxyphenyl)methyl]piperidin-3-yl]morpholine?
The IUPAC name of 4-[(3R)-1-[(4-cyclopentyloxyphenyl)methyl]piperidin-3-yl]morpholine (CID 92641147) is 4-[(3R)-1-[(4-cyclopentyloxyphenyl)methyl]piperidin-3-yl]morpholine.
What is the SMILES notation for 4-[(3R)-1-[(4-cyclopentyloxyphenyl)methyl]piperidin-3-yl]morpholine?
The canonical SMILES for 4-[(3R)-1-[(4-cyclopentyloxyphenyl)methyl]piperidin-3-yl]morpholine is c1cc(OC2CCCC2)ccc1CN1CCC[C@@H](N2CCOCC2)C1.
What is the InChIKey of 4-[(3R)-1-[(4-cyclopentyloxyphenyl)methyl]piperidin-3-yl]morpholine?
The InChIKey is ZTWVNFUJGGIVHQ-LJQANCHMSA-N. The full InChI is InChI=1S/C21H32N2O2/c1-2-6-20(5-1)25-21-9-7-18(8-10-21)16-22-11-3-4-19(17-22)23-12-14-24-15-13-23/h7-10,19-20H,1-6,11-17H2/t19-/m1/s1.
What are the key properties of 4-[(3R)-1-[(4-cyclopentyloxyphenyl)methyl]piperidin-3-yl]morpholine?
4-[(3R)-1-[(4-cyclopentyloxyphenyl)methyl]piperidin-3-yl]morpholine has a molecular weight of 344.50 g/mol, XLogP of 3.30, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3R)-1-[(4-cyclopentyloxyphenyl)methyl]piperidin-3-yl]morpholine is sourced from PubChem (CID 92641147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).