1-(3-morpholin-4-ylpyrrolidin-1-yl)-3-piperazin-1-ylpropan-2-ol

C15H30N4O2 — CID 65447751

IUPAC1-(3-morpholin-4-ylpyrrolidin-1-yl)-3-piperazin-1-ylpropan-2-ol
SMILESOC(CN1CCNCC1)CN1CCC(N2CCOCC2)C1
InChIInChI=1S/C15H30N4O2/c20-15(12-17-5-2-16-3-6-17)13-18-4-1-14(11-18)19-7-9-21-10-8-19/h14-16,20H,1-13H2
InChIKeyWDNJUPNNNUAUJJ-UHFFFAOYSA-N
MW298.43 g/mol
LogP-1.34
Rot. Bonds5

About 1-(3-morpholin-4-ylpyrrolidin-1-yl)-3-piperazin-1-ylpropan-2-ol

1-(3-morpholin-4-ylpyrrolidin-1-yl)-3-piperazin-1-ylpropan-2-ol (PubChem CID 65447751) has the molecular formula C15H30N4O2 and a molecular weight of 298.43 g/mol. Its IUPAC name is 1-(3-morpholin-4-ylpyrrolidin-1-yl)-3-piperazin-1-ylpropan-2-ol.

Molecular Properties

Compound Name1-(3-morpholin-4-ylpyrrolidin-1-yl)-3-piperazin-1-ylpropan-2-ol
PubChem CID65447751
Molecular FormulaC15H30N4O2
Molecular Weight298.43 g/mol
Exact Mass298.24
IUPAC Name1-(3-morpholin-4-ylpyrrolidin-1-yl)-3-piperazin-1-ylpropan-2-ol
SMILESOC(CN1CCNCC1)CN1CCC(N2CCOCC2)C1
InChIInChI=1S/C15H30N4O2/c20-15(12-17-5-2-16-3-6-17)13-18-4-1-14(11-18)19-7-9-21-10-8-19/h14-16,20H,1-13H2
InChIKeyWDNJUPNNNUAUJJ-UHFFFAOYSA-N
XLogP-1.34
TPSA51.21 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 5-1.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-(3-morpholin-4-ylpyrrolidin-1-yl)propan-2-ol
CID 63171130
(2S)-1-(1,4-diazepan-1-yl)-3-morpholin-4-ylpropan-2-ol
CID 95067014
1-butoxy-3-(3-morpholin-4-ylpyrrolidin-1-yl)propan-2-ol
CID 107263875
2-amino-3-(3-morpholin-4-ylpyrrolidin-1-yl)propan-1-ol
CID 64791499
1-[2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethyl]piperazine
CID 63169674
4-[1-(2-piperidin-4-yloxyethyl)pyrrolidin-3-yl]morpholine
CID 63903240
1-[1-(2,2-dimethoxyethyl)pyrrolidin-3-yl]piperazine
CID 112739446
2-(2-hydroxy-3-piperazin-1-ylpropyl)-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one
CID 82863355
N-methyl-1-(3-morpholin-4-ylpyrrolidin-1-yl)pentan-2-amine
CID 63169568
1-(3-morpholin-4-ylpyrrolidin-1-yl)hexan-2-amine
CID 63534762
1-(3-piperidin-1-ylpyrrolidin-1-yl)butan-2-ol
CID 63170952
2,2-dimethyl-4-(3-morpholin-4-ylpyrrolidin-1-yl)butanoic acid
CID 65248073

Frequently Asked Questions

What is the IUPAC name of 1-(3-morpholin-4-ylpyrrolidin-1-yl)-3-piperazin-1-ylpropan-2-ol?
The IUPAC name of 1-(3-morpholin-4-ylpyrrolidin-1-yl)-3-piperazin-1-ylpropan-2-ol (CID 65447751) is 1-(3-morpholin-4-ylpyrrolidin-1-yl)-3-piperazin-1-ylpropan-2-ol.
What is the SMILES notation for 1-(3-morpholin-4-ylpyrrolidin-1-yl)-3-piperazin-1-ylpropan-2-ol?
The canonical SMILES for 1-(3-morpholin-4-ylpyrrolidin-1-yl)-3-piperazin-1-ylpropan-2-ol is OC(CN1CCNCC1)CN1CCC(N2CCOCC2)C1.
What is the InChIKey of 1-(3-morpholin-4-ylpyrrolidin-1-yl)-3-piperazin-1-ylpropan-2-ol?
The InChIKey is WDNJUPNNNUAUJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N4O2/c20-15(12-17-5-2-16-3-6-17)13-18-4-1-14(11-18)19-7-9-21-10-8-19/h14-16,20H,1-13H2.
What are the key properties of 1-(3-morpholin-4-ylpyrrolidin-1-yl)-3-piperazin-1-ylpropan-2-ol?
1-(3-morpholin-4-ylpyrrolidin-1-yl)-3-piperazin-1-ylpropan-2-ol has a molecular weight of 298.43 g/mol, XLogP of -1.34, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-morpholin-4-ylpyrrolidin-1-yl)-3-piperazin-1-ylpropan-2-ol is sourced from PubChem (CID 65447751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).