3-[2-(morpholin-4-ylmethyl)imidazol-1-yl]propan-1-ol

C11H19N3O2 — CID 91503690

IUPAC3-[2-(morpholin-4-ylmethyl)imidazol-1-yl]propan-1-ol
SMILESOCCCn1ccnc1CN1CCOCC1
InChIInChI=1S/C11H19N3O2/c15-7-1-3-14-4-2-12-11(14)10-13-5-8-16-9-6-13/h2,4,15H,1,3,5-10H2
InChIKeyUXCCZGGPVASKNJ-UHFFFAOYSA-N
MW225.29 g/mol
LogP0.10
Rot. Bonds5

About 3-[2-(morpholin-4-ylmethyl)imidazol-1-yl]propan-1-ol

3-[2-(morpholin-4-ylmethyl)imidazol-1-yl]propan-1-ol (PubChem CID 91503690) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is 3-[2-(morpholin-4-ylmethyl)imidazol-1-yl]propan-1-ol.

Molecular Properties

Compound Name3-[2-(morpholin-4-ylmethyl)imidazol-1-yl]propan-1-ol
PubChem CID91503690
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC Name3-[2-(morpholin-4-ylmethyl)imidazol-1-yl]propan-1-ol
SMILESOCCCn1ccnc1CN1CCOCC1
InChIInChI=1S/C11H19N3O2/c15-7-1-3-14-4-2-12-11(14)10-13-5-8-16-9-6-13/h2,4,15H,1,3,5-10H2
InChIKeyUXCCZGGPVASKNJ-UHFFFAOYSA-N
XLogP0.10
TPSA50.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 50.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 5-[2-(morpholin-4-ylmethyl)imidazol-1-yl]pentanoate
CID 167876752
4-[2-(2-morpholin-4-ylethyl)imidazol-1-yl]butan-1-amine
CID 82558293
2-[1-(2-morpholin-4-ylethyl)imidazol-2-yl]acetic acid
CID 69289077
1-[4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]-3-morpholin-4-ylpropan-2-ol
CID 154737586
3-[4-[[1-(difluoromethyl)imidazol-2-yl]methyl]piperazin-1-yl]propan-1-ol
CID 111544146
[2-methyl-4-[(1-propylimidazol-2-yl)methyl]morpholin-2-yl]-morpholin-4-ylmethanone
CID 127247751
N-[[1-(2-morpholin-4-ylethyl)imidazol-2-yl]methyl]propan-1-amine
CID 55048615
2-[2-(2-morpholin-4-ylethyl)imidazol-1-yl]acetic acid
CID 82560173
N-methyl-2-[2-(morpholin-4-ylmethyl)imidazol-1-yl]-N-(thiophen-2-ylmethyl)acetamide
CID 126837087
(6R)-1-[(1-benzylimidazol-2-yl)methyl]-4-(3-hydroxypropyl)-1,4-diazepan-6-ol
CID 100599963
4-[3-[2-[(3-bromophenyl)methyl]imidazol-1-yl]propyl]morpholine
CID 82561888
(NE)-N-[[1-(2-morpholin-4-ylethyl)imidazol-2-yl]methylidene]hydroxylamine
CID 140737146

Frequently Asked Questions

What is the IUPAC name of 3-[2-(morpholin-4-ylmethyl)imidazol-1-yl]propan-1-ol?
The IUPAC name of 3-[2-(morpholin-4-ylmethyl)imidazol-1-yl]propan-1-ol (CID 91503690) is 3-[2-(morpholin-4-ylmethyl)imidazol-1-yl]propan-1-ol.
What is the SMILES notation for 3-[2-(morpholin-4-ylmethyl)imidazol-1-yl]propan-1-ol?
The canonical SMILES for 3-[2-(morpholin-4-ylmethyl)imidazol-1-yl]propan-1-ol is OCCCn1ccnc1CN1CCOCC1.
What is the InChIKey of 3-[2-(morpholin-4-ylmethyl)imidazol-1-yl]propan-1-ol?
The InChIKey is UXCCZGGPVASKNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c15-7-1-3-14-4-2-12-11(14)10-13-5-8-16-9-6-13/h2,4,15H,1,3,5-10H2.
What are the key properties of 3-[2-(morpholin-4-ylmethyl)imidazol-1-yl]propan-1-ol?
3-[2-(morpholin-4-ylmethyl)imidazol-1-yl]propan-1-ol has a molecular weight of 225.29 g/mol, XLogP of 0.10, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(morpholin-4-ylmethyl)imidazol-1-yl]propan-1-ol is sourced from PubChem (CID 91503690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).