1-[2-[(1-methylimidazol-2-yl)amino]ethyl]cyclobutan-1-ol

C10H17N3O — CID 131196729

IUPAC1-[2-[(1-methylimidazol-2-yl)amino]ethyl]cyclobutan-1-ol
SMILESCn1ccnc1NCCC1(O)CCC1
InChIInChI=1S/C10H17N3O/c1-13-8-7-12-9(13)11-6-5-10(14)3-2-4-10/h7-8,14H,2-6H2,1H3,(H,11,12)
InChIKeyHMTAVOHKYJXNKQ-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.14
Rot. Bonds4

About 1-[2-[(1-methylimidazol-2-yl)amino]ethyl]cyclobutan-1-ol

1-[2-[(1-methylimidazol-2-yl)amino]ethyl]cyclobutan-1-ol (PubChem CID 131196729) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 1-[2-[(1-methylimidazol-2-yl)amino]ethyl]cyclobutan-1-ol.

Molecular Properties

Compound Name1-[2-[(1-methylimidazol-2-yl)amino]ethyl]cyclobutan-1-ol
PubChem CID131196729
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name1-[2-[(1-methylimidazol-2-yl)amino]ethyl]cyclobutan-1-ol
SMILESCn1ccnc1NCCC1(O)CCC1
InChIInChI=1S/C10H17N3O/c1-13-8-7-12-9(13)11-6-5-10(14)3-2-4-10/h7-8,14H,2-6H2,1H3,(H,11,12)
InChIKeyHMTAVOHKYJXNKQ-UHFFFAOYSA-N
XLogP1.14
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[[2-(1-methylimidazol-2-yl)ethylamino]methyl]cyclopentan-1-ol
CID 65210949
N-[2-[(1-methylimidazol-2-yl)amino]ethyl]acetamide
CID 62133096
N-[2-(2-methoxyethoxy)ethyl]-1-methylimidazol-2-amine
CID 62133824
2-methyl-1-[(1-methylimidazol-2-yl)amino]propan-2-ol
CID 65108978
N-cyclopropyl-N'-(1-methylimidazol-2-yl)propane-1,3-diamine
CID 62132212
2-methyl-4-[(1-methylimidazol-2-yl)amino]butanoic acid
CID 80539688
1-[[(1-ethylimidazol-2-yl)amino]methyl]cyclopentan-1-ol
CID 65110887
1-[(1-methylimidazol-2-yl)amino]cyclopropane-1-carboxylic acid
CID 65452666
2-[(1-methylimidazol-2-yl)amino]-N-propan-2-ylacetamide
CID 62133098
1-methyl-N-[2-(trifluoromethylsulfanyl)ethyl]imidazol-2-amine
CID 106430806
3-[[(1S)-1-hydroxy-2,2-dimethylcyclopentyl]methylamino]-1-methylpyrazin-2-one
CID 164637001
4-[2-(1-methylimidazol-2-yl)ethyl]oxan-4-ol
CID 114529027

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(1-methylimidazol-2-yl)amino]ethyl]cyclobutan-1-ol?
The IUPAC name of 1-[2-[(1-methylimidazol-2-yl)amino]ethyl]cyclobutan-1-ol (CID 131196729) is 1-[2-[(1-methylimidazol-2-yl)amino]ethyl]cyclobutan-1-ol.
What is the SMILES notation for 1-[2-[(1-methylimidazol-2-yl)amino]ethyl]cyclobutan-1-ol?
The canonical SMILES for 1-[2-[(1-methylimidazol-2-yl)amino]ethyl]cyclobutan-1-ol is Cn1ccnc1NCCC1(O)CCC1.
What is the InChIKey of 1-[2-[(1-methylimidazol-2-yl)amino]ethyl]cyclobutan-1-ol?
The InChIKey is HMTAVOHKYJXNKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-13-8-7-12-9(13)11-6-5-10(14)3-2-4-10/h7-8,14H,2-6H2,1H3,(H,11,12).
What are the key properties of 1-[2-[(1-methylimidazol-2-yl)amino]ethyl]cyclobutan-1-ol?
1-[2-[(1-methylimidazol-2-yl)amino]ethyl]cyclobutan-1-ol has a molecular weight of 195.27 g/mol, XLogP of 1.14, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(1-methylimidazol-2-yl)amino]ethyl]cyclobutan-1-ol is sourced from PubChem (CID 131196729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).