2-(4,5-dihydro-1H-imidazol-2-ylamino)-1-morpholin-4-ylpropan-1-one

C10H18N4O2 — CID 114400401

IUPAC2-(4,5-dihydro-1H-imidazol-2-ylamino)-1-morpholin-4-ylpropan-1-one
SMILESCC(NC1=NCCN1)C(=O)N1CCOCC1
InChIInChI=1S/C10H18N4O2/c1-8(13-10-11-2-3-12-10)9(15)14-4-6-16-7-5-14/h8H,2-7H2,1H3,(H2,11,12,13)
InChIKeyPGTPIKPZCFMCAA-UHFFFAOYSA-N
MW226.28 g/mol
LogP-1.22
Rot. Bonds2

About 2-(4,5-dihydro-1H-imidazol-2-ylamino)-1-morpholin-4-ylpropan-1-one

2-(4,5-dihydro-1H-imidazol-2-ylamino)-1-morpholin-4-ylpropan-1-one (PubChem CID 114400401) has the molecular formula C10H18N4O2 and a molecular weight of 226.28 g/mol. Its IUPAC name is 2-(4,5-dihydro-1H-imidazol-2-ylamino)-1-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name2-(4,5-dihydro-1H-imidazol-2-ylamino)-1-morpholin-4-ylpropan-1-one
PubChem CID114400401
Molecular FormulaC10H18N4O2
Molecular Weight226.28 g/mol
Exact Mass226.14
IUPAC Name2-(4,5-dihydro-1H-imidazol-2-ylamino)-1-morpholin-4-ylpropan-1-one
SMILESCC(NC1=NCCN1)C(=O)N1CCOCC1
InChIInChI=1S/C10H18N4O2/c1-8(13-10-11-2-3-12-10)9(15)14-4-6-16-7-5-14/h8H,2-7H2,1H3,(H2,11,12,13)
InChIKeyPGTPIKPZCFMCAA-UHFFFAOYSA-N
XLogP-1.22
TPSA65.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 5-1.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(1-methyl-4,5-dihydroimidazol-2-yl)amino]-1-morpholin-4-ylpropan-1-one
CID 112749321
2-[(5-bromo-1,3,4-thiadiazol-2-yl)amino]-1-morpholin-4-ylpropan-1-one
CID 115898996
2-[(3-methyl-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one
CID 113408683
2-[(3-bromo-4-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one
CID 104777234
5-bromo-4-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]-1H-pyridazin-6-one
CID 114386240
2-[(3-fluoro-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one
CID 112551724
[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]carbamic acid
CID 67759315
2-[(6-chloro-2-methylpyrimidin-4-yl)amino]-1-morpholin-4-ylpropan-1-one
CID 112689350
2-methyl-6-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]pyridine-4-carbonitrile
CID 114766592
1-morpholin-4-yl-2-[4-(trifluoromethyl)anilino]propan-1-one
CID 43084708
1-piperazin-1-yl-2-(pyrimidin-2-ylamino)propan-1-one
CID 82510577
2-[3-(dimethylamino)-4-methylanilino]-1-morpholin-4-ylpropan-1-one
CID 115378152

Frequently Asked Questions

What is the IUPAC name of 2-(4,5-dihydro-1H-imidazol-2-ylamino)-1-morpholin-4-ylpropan-1-one?
The IUPAC name of 2-(4,5-dihydro-1H-imidazol-2-ylamino)-1-morpholin-4-ylpropan-1-one (CID 114400401) is 2-(4,5-dihydro-1H-imidazol-2-ylamino)-1-morpholin-4-ylpropan-1-one.
What is the SMILES notation for 2-(4,5-dihydro-1H-imidazol-2-ylamino)-1-morpholin-4-ylpropan-1-one?
The canonical SMILES for 2-(4,5-dihydro-1H-imidazol-2-ylamino)-1-morpholin-4-ylpropan-1-one is CC(NC1=NCCN1)C(=O)N1CCOCC1.
What is the InChIKey of 2-(4,5-dihydro-1H-imidazol-2-ylamino)-1-morpholin-4-ylpropan-1-one?
The InChIKey is PGTPIKPZCFMCAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2/c1-8(13-10-11-2-3-12-10)9(15)14-4-6-16-7-5-14/h8H,2-7H2,1H3,(H2,11,12,13).
What are the key properties of 2-(4,5-dihydro-1H-imidazol-2-ylamino)-1-morpholin-4-ylpropan-1-one?
2-(4,5-dihydro-1H-imidazol-2-ylamino)-1-morpholin-4-ylpropan-1-one has a molecular weight of 226.28 g/mol, XLogP of -1.22, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,5-dihydro-1H-imidazol-2-ylamino)-1-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 114400401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).