2-[(1-methylimidazol-2-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol

C11H20N4O — CID 106621365

IUPAC2-[(1-methylimidazol-2-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol
SMILESCn1ccnc1N(CCO)CC1CCCN1
InChIInChI=1S/C11H20N4O/c1-14-6-5-13-11(14)15(7-8-16)9-10-3-2-4-12-10/h5-6,10,12,16H,2-4,7-9H2,1H3
InChIKeyNZLHIRGJXNTSKP-UHFFFAOYSA-N
MW224.31 g/mol
LogP-0.03
Rot. Bonds5

About 2-[(1-methylimidazol-2-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol

2-[(1-methylimidazol-2-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol (PubChem CID 106621365) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is 2-[(1-methylimidazol-2-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol.

Molecular Properties

Compound Name2-[(1-methylimidazol-2-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol
PubChem CID106621365
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC Name2-[(1-methylimidazol-2-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol
SMILESCn1ccnc1N(CCO)CC1CCCN1
InChIInChI=1S/C11H20N4O/c1-14-6-5-13-11(14)15(7-8-16)9-10-3-2-4-12-10/h5-6,10,12,16H,2-4,7-9H2,1H3
InChIKeyNZLHIRGJXNTSKP-UHFFFAOYSA-N
XLogP-0.03
TPSA53.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-methyl-N-(piperidin-2-ylmethyl)-N-propylimidazol-2-amine
CID 106642484
3-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]-1-propan-2-ylpyrazin-2-one
CID 106621438
1-ethyl-3-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]pyrazin-2-one
CID 106621403
2-[pyrrolidin-2-ylmethyl([1,2,4]triazolo[4,3-a]pyrazin-8-yl)amino]ethanol
CID 106621339
N-methyl-N-[(1-methylimidazol-2-yl)methyl]-1-[(2R)-pyrrolidin-2-yl]methanamine
CID 94939254
N-(cyclopropylmethyl)-1-ethyl-N-(pyrrolidin-2-ylmethyl)imidazol-2-amine
CID 106619952
2-[(5-methyl-2-pyridinyl)-(pyrrolidin-2-ylmethyl)amino]ethanol
CID 106621156
2-[(3,5-difluoro-2-pyridinyl)-(pyrrolidin-2-ylmethyl)amino]ethanol
CID 106621171
2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol
CID 106621336
2-[pyrrolidin-2-ylmethyl-[4-(trifluoromethyl)pyrimidin-2-yl]amino]ethanol
CID 106621340
N-methyl-2-(1-methylimidazol-2-yl)-N-(piperidin-2-ylmethyl)ethanamine
CID 106635225
2-[pyrrolidin-2-ylmethyl(quinolin-4-yl)amino]ethanol
CID 106621399

Frequently Asked Questions

What is the IUPAC name of 2-[(1-methylimidazol-2-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol?
The IUPAC name of 2-[(1-methylimidazol-2-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol (CID 106621365) is 2-[(1-methylimidazol-2-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol.
What is the SMILES notation for 2-[(1-methylimidazol-2-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol?
The canonical SMILES for 2-[(1-methylimidazol-2-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol is Cn1ccnc1N(CCO)CC1CCCN1.
What is the InChIKey of 2-[(1-methylimidazol-2-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol?
The InChIKey is NZLHIRGJXNTSKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O/c1-14-6-5-13-11(14)15(7-8-16)9-10-3-2-4-12-10/h5-6,10,12,16H,2-4,7-9H2,1H3.
What are the key properties of 2-[(1-methylimidazol-2-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol?
2-[(1-methylimidazol-2-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol has a molecular weight of 224.31 g/mol, XLogP of -0.03, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-methylimidazol-2-yl)-(pyrrolidin-2-ylmethyl)amino]ethanol is sourced from PubChem (CID 106621365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).