N-phenylmorpholin-4-amine;dihydrochloride

C10H16Cl2N2O — CID 159085385

IUPACN-phenylmorpholin-4-amine;dihydrochloride
SMILESCl.Cl.c1ccc(NN2CCOCC2)cc1
InChIInChI=1S/C10H14N2O.2ClH/c1-2-4-10(5-3-1)11-12-6-8-13-9-7-12;;/h1-5,11H,6-9H2;2*1H
InChIKeyKBJPKVGAEITDME-UHFFFAOYSA-N
MW251.16 g/mol
LogP2.19
Rot. Bonds2

About N-phenylmorpholin-4-amine;dihydrochloride

N-phenylmorpholin-4-amine;dihydrochloride (PubChem CID 159085385) has the molecular formula C10H16Cl2N2O and a molecular weight of 251.16 g/mol. Its IUPAC name is N-phenylmorpholin-4-amine;dihydrochloride.

Molecular Properties

Compound NameN-phenylmorpholin-4-amine;dihydrochloride
PubChem CID159085385
Molecular FormulaC10H16Cl2N2O
Molecular Weight251.16 g/mol
Exact Mass250.06
IUPAC NameN-phenylmorpholin-4-amine;dihydrochloride
SMILESCl.Cl.c1ccc(NN2CCOCC2)cc1
InChIInChI=1S/C10H14N2O.2ClH/c1-2-4-10(5-3-1)11-12-6-8-13-9-7-12;;/h1-5,11H,6-9H2;2*1H
InChIKeyKBJPKVGAEITDME-UHFFFAOYSA-N
XLogP2.19
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.16
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-naphthalen-2-ylmorpholin-4-amine
CID 69398473
N-phenylmorpholin-4-amine;pyrene-1-carbaldehyde
CID 175197775
4-methyl-N-phenylpiperazin-1-amine
CID 22361228
4-(morpholin-4-ylamino)benzenesulfonamide
CID 83026277
3-fluoro-N-phenylmorpholin-4-amine
CID 54041051
4-morpholin-4-yl-N-phenylaniline
CID 159018746
N,N-dimethyl-4-(morpholin-4-ylamino)benzenesulfonamide
CID 83025680
2-(morpholin-4-ylamino)-N-phenylacetamide
CID 83021933
1-bis(morpholin-4-ylamino)phosphoryl-N-phenylformamide
CID 50908761
N-phenylmorpholine-4-carbothioamide
CID 139054920
N-(2-methylsulfonylphenyl)morpholin-4-amine
CID 115279132
N-(4-phenyl-4,5-dihydro-1,3-thiazol-2-yl)morpholin-4-amine
CID 83019412

Frequently Asked Questions

What is the IUPAC name of N-phenylmorpholin-4-amine;dihydrochloride?
The IUPAC name of N-phenylmorpholin-4-amine;dihydrochloride (CID 159085385) is N-phenylmorpholin-4-amine;dihydrochloride.
What is the SMILES notation for N-phenylmorpholin-4-amine;dihydrochloride?
The canonical SMILES for N-phenylmorpholin-4-amine;dihydrochloride is Cl.Cl.c1ccc(NN2CCOCC2)cc1.
What is the InChIKey of N-phenylmorpholin-4-amine;dihydrochloride?
The InChIKey is KBJPKVGAEITDME-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O.2ClH/c1-2-4-10(5-3-1)11-12-6-8-13-9-7-12;;/h1-5,11H,6-9H2;2*1H.
What are the key properties of N-phenylmorpholin-4-amine;dihydrochloride?
N-phenylmorpholin-4-amine;dihydrochloride has a molecular weight of 251.16 g/mol, XLogP of 2.19, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenylmorpholin-4-amine;dihydrochloride is sourced from PubChem (CID 159085385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).