molecular hydrogen;3-morpholin-4-yl-N-propan-2-ylpropan-1-amine

C10H24N2O — CID 142256465

IUPACmolecular hydrogen;3-morpholin-4-yl-N-propan-2-ylpropan-1-amine
SMILESCC(C)NCCCN1CCOCC1.[H][H]
InChIInChI=1S/C10H22N2O.H2/c1-10(2)11-4-3-5-12-6-8-13-9-7-12;/h10-11H,3-9H2,1-2H3;1H
InChIKeyKUDMNYJMXQCBAS-UHFFFAOYSA-N
MW188.31 g/mol
LogP0.95
Rot. Bonds5

About molecular hydrogen;3-morpholin-4-yl-N-propan-2-ylpropan-1-amine

molecular hydrogen;3-morpholin-4-yl-N-propan-2-ylpropan-1-amine (PubChem CID 142256465) has the molecular formula C10H24N2O and a molecular weight of 188.31 g/mol. Its IUPAC name is molecular hydrogen;3-morpholin-4-yl-N-propan-2-ylpropan-1-amine.

Molecular Properties

Compound Namemolecular hydrogen;3-morpholin-4-yl-N-propan-2-ylpropan-1-amine
PubChem CID142256465
Molecular FormulaC10H24N2O
Molecular Weight188.31 g/mol
Exact Mass188.19
IUPAC Namemolecular hydrogen;3-morpholin-4-yl-N-propan-2-ylpropan-1-amine
SMILESCC(C)NCCCN1CCOCC1.[H][H]
InChIInChI=1S/C10H22N2O.H2/c1-10(2)11-4-3-5-12-6-8-13-9-7-12;/h10-11H,3-9H2,1-2H3;1H
InChIKeyKUDMNYJMXQCBAS-UHFFFAOYSA-N
XLogP0.95
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of molecular hydrogen;3-morpholin-4-yl-N-propan-2-ylpropan-1-amine?
The IUPAC name of molecular hydrogen;3-morpholin-4-yl-N-propan-2-ylpropan-1-amine (CID 142256465) is molecular hydrogen;3-morpholin-4-yl-N-propan-2-ylpropan-1-amine.
What is the SMILES notation for molecular hydrogen;3-morpholin-4-yl-N-propan-2-ylpropan-1-amine?
The canonical SMILES for molecular hydrogen;3-morpholin-4-yl-N-propan-2-ylpropan-1-amine is CC(C)NCCCN1CCOCC1.[H][H].
What is the InChIKey of molecular hydrogen;3-morpholin-4-yl-N-propan-2-ylpropan-1-amine?
The InChIKey is KUDMNYJMXQCBAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O.H2/c1-10(2)11-4-3-5-12-6-8-13-9-7-12;/h10-11H,3-9H2,1-2H3;1H.
What are the key properties of molecular hydrogen;3-morpholin-4-yl-N-propan-2-ylpropan-1-amine?
molecular hydrogen;3-morpholin-4-yl-N-propan-2-ylpropan-1-amine has a molecular weight of 188.31 g/mol, XLogP of 0.95, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for molecular hydrogen;3-morpholin-4-yl-N-propan-2-ylpropan-1-amine is sourced from PubChem (CID 142256465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).