[4-(3-azaspiro[5.5]undecan-9-yl)piperazin-1-yl]-morpholin-4-ylmethanone;dihydrochloride

C19H36Cl2N4O2 — CID 154887650

IUPAC[4-(3-azaspiro[5.5]undecan-9-yl)piperazin-1-yl]-morpholin-4-ylmethanone;dihydrochloride
SMILESCl.Cl.O=C(N1CCOCC1)N1CCN(C2CCC3(CCNCC3)CC2)CC1
InChIInChI=1S/C19H34N4O2.2ClH/c24-18(23-13-15-25-16-14-23)22-11-9-21(10-12-22)17-1-3-19(4-2-17)5-7-20-8-6-19;;/h17,20H,1-16H2;2*1H
InChIKeyIZZVWNKMUHRYFC-UHFFFAOYSA-N
MW423.43 g/mol
LogP2.21
Rot. Bonds1

About [4-(3-azaspiro[5.5]undecan-9-yl)piperazin-1-yl]-morpholin-4-ylmethanone;dihydrochloride

[4-(3-azaspiro[5.5]undecan-9-yl)piperazin-1-yl]-morpholin-4-ylmethanone;dihydrochloride (PubChem CID 154887650) has the molecular formula C19H36Cl2N4O2 and a molecular weight of 423.43 g/mol. Its IUPAC name is [4-(3-azaspiro[5.5]undecan-9-yl)piperazin-1-yl]-morpholin-4-ylmethanone;dihydrochloride.

Molecular Properties

Compound Name[4-(3-azaspiro[5.5]undecan-9-yl)piperazin-1-yl]-morpholin-4-ylmethanone;dihydrochloride
PubChem CID154887650
Molecular FormulaC19H36Cl2N4O2
Molecular Weight423.43 g/mol
Exact Mass422.22
IUPAC Name[4-(3-azaspiro[5.5]undecan-9-yl)piperazin-1-yl]-morpholin-4-ylmethanone;dihydrochloride
SMILESCl.Cl.O=C(N1CCOCC1)N1CCN(C2CCC3(CCNCC3)CC2)CC1
InChIInChI=1S/C19H34N4O2.2ClH/c24-18(23-13-15-25-16-14-23)22-11-9-21(10-12-22)17-1-3-19(4-2-17)5-7-20-8-6-19;;/h17,20H,1-16H2;2*1H
InChIKeyIZZVWNKMUHRYFC-UHFFFAOYSA-N
XLogP2.21
TPSA48.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.43
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [4-(3-azaspiro[5.5]undecan-9-yl)piperazin-1-yl]-morpholin-4-ylmethanone;dihydrochloride 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

4-(8-azaspiro[4.5]decan-3-yl)morpholine;hydrochloride
CID 169144139
3-(3-azaspiro[5.5]undecan-9-yl)-3,9-diazaspiro[5.5]undecane
CID 146248908
N-[1-(oxan-4-yl)piperidin-4-yl]-3-azaspiro[5.5]undecan-9-amine
CID 56719040
[4-(3-azaspiro[5.5]undecan-9-yl)piperazin-1-yl]-(furan-2-yl)methanone
CID 56722979
(4-cyclopentylpiperazin-1-yl)-piperazin-1-ylmethanone
CID 55063692
1-[4-(oxan-4-yl)piperazin-1-yl]-2-piperidin-4-ylethanone
CID 131933898
9-(4-ethylpiperazin-1-yl)-3-azaspiro[5.5]undecane
CID 171641603
ethane;9-(4-ethylpiperazin-1-yl)-3-azaspiro[5.5]undecane
CID 171641602
2-(oxan-4-yl)-2,8-diazaspiro[4.5]decane
CID 169161347
4-(morpholine-4-carbonyl)-N-(piperidin-4-ylmethyl)piperazine-1-carboxamide
CID 167899614
cyclopropyl-[4-(morpholine-4-carbonyl)piperazin-1-yl]methanone
CID 110346881
ethane;1-(4-piperidin-4-ylpiperazin-1-yl)ethanone
CID 145305613

Frequently Asked Questions

What is the IUPAC name of [4-(3-azaspiro[5.5]undecan-9-yl)piperazin-1-yl]-morpholin-4-ylmethanone;dihydrochloride?
The IUPAC name of [4-(3-azaspiro[5.5]undecan-9-yl)piperazin-1-yl]-morpholin-4-ylmethanone;dihydrochloride (CID 154887650) is [4-(3-azaspiro[5.5]undecan-9-yl)piperazin-1-yl]-morpholin-4-ylmethanone;dihydrochloride.
What is the SMILES notation for [4-(3-azaspiro[5.5]undecan-9-yl)piperazin-1-yl]-morpholin-4-ylmethanone;dihydrochloride?
The canonical SMILES for [4-(3-azaspiro[5.5]undecan-9-yl)piperazin-1-yl]-morpholin-4-ylmethanone;dihydrochloride is Cl.Cl.O=C(N1CCOCC1)N1CCN(C2CCC3(CCNCC3)CC2)CC1.
What is the InChIKey of [4-(3-azaspiro[5.5]undecan-9-yl)piperazin-1-yl]-morpholin-4-ylmethanone;dihydrochloride?
The InChIKey is IZZVWNKMUHRYFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34N4O2.2ClH/c24-18(23-13-15-25-16-14-23)22-11-9-21(10-12-22)17-1-3-19(4-2-17)5-7-20-8-6-19;;/h17,20H,1-16H2;2*1H.
What are the key properties of [4-(3-azaspiro[5.5]undecan-9-yl)piperazin-1-yl]-morpholin-4-ylmethanone;dihydrochloride?
[4-(3-azaspiro[5.5]undecan-9-yl)piperazin-1-yl]-morpholin-4-ylmethanone;dihydrochloride has a molecular weight of 423.43 g/mol, XLogP of 2.21, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-azaspiro[5.5]undecan-9-yl)piperazin-1-yl]-morpholin-4-ylmethanone;dihydrochloride is sourced from PubChem (CID 154887650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).