(3-morpholin-3-ylcyclopentyl)azanium

C9H19N2O+ — CID 163746361

IUPAC(3-morpholin-3-ylcyclopentyl)azanium
SMILES[NH3+]C1CCC(C2COCCN2)C1
InChIInChI=1S/C9H18N2O/c10-8-2-1-7(5-8)9-6-12-4-3-11-9/h7-9,11H,1-6,10H2/p+1
InChIKeyLMFLYFROABQCPF-UHFFFAOYSA-O
MW171.26 g/mol
LogP-0.61
Rot. Bonds1

About (3-morpholin-3-ylcyclopentyl)azanium

(3-morpholin-3-ylcyclopentyl)azanium (PubChem CID 163746361) has the molecular formula C9H19N2O+ and a molecular weight of 171.26 g/mol. Its IUPAC name is (3-morpholin-3-ylcyclopentyl)azanium.

Molecular Properties

Compound Name(3-morpholin-3-ylcyclopentyl)azanium
PubChem CID163746361
Molecular FormulaC9H19N2O+
Molecular Weight171.26 g/mol
Exact Mass171.15
IUPAC Name(3-morpholin-3-ylcyclopentyl)azanium
SMILES[NH3+]C1CCC(C2COCCN2)C1
InChIInChI=1S/C9H18N2O/c10-8-2-1-7(5-8)9-6-12-4-3-11-9/h7-9,11H,1-6,10H2/p+1
InChIKeyLMFLYFROABQCPF-UHFFFAOYSA-O
XLogP-0.61
TPSA48.90 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.26
LogP ≤ 5-0.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclohexylmorpholine
CID 54373245
(3S)-3-[(3S)-morpholin-3-yl]morpholine
CID 11693975
3-[4-(trifluoromethyl)cyclohexyl]morpholine
CID 149088087
1,2,3,3a,4,5,7,7a-octahydropyrano[3,4-b]pyrrole
CID 68902591
3-(1-methylpiperidin-3-yl)morpholine
CID 82406439
(3S)-3-(5H-tetrazol-5-yl)morpholine
CID 129389237
trans-(1R,2S)-2-[(3S)-morpholin-3-yl]cyclopentan-1-ol
CID 124709951
N-(2-cyclohexylcyclopropyl)-2-morpholin-3-ylcyclopentan-1-amine
CID 120915989
2,3,4,4a,5,6,8,8a-octahydro-1H-pyrano[3,4-b]pyridine-3-carboxylic acid
CID 83817432
(2S)-2-[(3S)-morpholin-3-yl]cyclohexan-1-one
CID 96581630
5,9-dioxa-2-azabicyclo[6.2.0]decane
CID 122672123
(4aS,8aS)-2,3,4,4a,5,7,8,8a-octahydro-1H-pyrano[4,3-b]pyridine
CID 92794225

Frequently Asked Questions

What is the IUPAC name of (3-morpholin-3-ylcyclopentyl)azanium?
The IUPAC name of (3-morpholin-3-ylcyclopentyl)azanium (CID 163746361) is (3-morpholin-3-ylcyclopentyl)azanium.
What is the SMILES notation for (3-morpholin-3-ylcyclopentyl)azanium?
The canonical SMILES for (3-morpholin-3-ylcyclopentyl)azanium is [NH3+]C1CCC(C2COCCN2)C1.
What is the InChIKey of (3-morpholin-3-ylcyclopentyl)azanium?
The InChIKey is LMFLYFROABQCPF-UHFFFAOYSA-O. The full InChI is InChI=1S/C9H18N2O/c10-8-2-1-7(5-8)9-6-12-4-3-11-9/h7-9,11H,1-6,10H2/p+1.
What are the key properties of (3-morpholin-3-ylcyclopentyl)azanium?
(3-morpholin-3-ylcyclopentyl)azanium has a molecular weight of 171.26 g/mol, XLogP of -0.61, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-morpholin-3-ylcyclopentyl)azanium is sourced from PubChem (CID 163746361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).