(4-hydroxypiperidin-1-yl)-(1-methylimidazol-4-yl)methanone

C10H15N3O2 — CID 103817135

IUPAC(4-hydroxypiperidin-1-yl)-(1-methylimidazol-4-yl)methanone
SMILESCn1cnc(C(=O)N2CCC(O)CC2)c1
InChIInChI=1S/C10H15N3O2/c1-12-6-9(11-7-12)10(15)13-4-2-8(14)3-5-13/h6-8,14H,2-5H2,1H3
InChIKeyLCEGPGZKMLYSRD-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.02
Rot. Bonds1

About (4-hydroxypiperidin-1-yl)-(1-methylimidazol-4-yl)methanone

(4-hydroxypiperidin-1-yl)-(1-methylimidazol-4-yl)methanone (PubChem CID 103817135) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is (4-hydroxypiperidin-1-yl)-(1-methylimidazol-4-yl)methanone.

Molecular Properties

Compound Name(4-hydroxypiperidin-1-yl)-(1-methylimidazol-4-yl)methanone
PubChem CID103817135
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name(4-hydroxypiperidin-1-yl)-(1-methylimidazol-4-yl)methanone
SMILESCn1cnc(C(=O)N2CCC(O)CC2)c1
InChIInChI=1S/C10H15N3O2/c1-12-6-9(11-7-12)10(15)13-4-2-8(14)3-5-13/h6-8,14H,2-5H2,1H3
InChIKeyLCEGPGZKMLYSRD-UHFFFAOYSA-N
XLogP0.02
TPSA58.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1-methylimidazol-4-yl)-pyrrolidin-1-ylmethanone
CID 20703282
[4-(aminomethyl)piperidin-1-yl]-(1-methylimidazol-4-yl)methanone
CID 107970864
(3-chloro-4-methylpiperidin-1-yl)-(1-methylimidazol-4-yl)methanone
CID 107975437
[4-(ethylamino)piperidin-1-yl]-(1-methylimidazol-4-yl)methanone
CID 107970772
(4-tert-butylazepan-1-yl)-(1-methylimidazol-4-yl)methanone
CID 118771341
3-methyl-1-(1-methylimidazole-4-carbonyl)piperidine-4-carboxylic acid
CID 114278485
(1-methylimidazol-4-yl)-[4-(1-methylsulfonylpiperidin-4-yl)oxypiperidin-1-yl]methanone
CID 91916386
(3S)-1-(1-methylimidazole-4-carbonyl)piperidine-3-carboxylic acid
CID 107971610
(3,5-dimethylpiperazin-1-yl)-(1-methylimidazol-4-yl)methanone
CID 20703295
[4-(2,5-dimethylphenoxy)piperidin-1-yl]-(1-methylimidazol-4-yl)methanone
CID 145375199
[(4R,5S)-4,5-dihydroxy-4-methyl-1-oxa-9-azaspiro[5.5]undecan-9-yl]-(1-methylimidazol-4-yl)methanone
CID 135100932
[4-(ethylamino)-3-methylpiperidin-1-yl]-(1-methylimidazol-4-yl)methanone
CID 114022412

Frequently Asked Questions

What is the IUPAC name of (4-hydroxypiperidin-1-yl)-(1-methylimidazol-4-yl)methanone?
The IUPAC name of (4-hydroxypiperidin-1-yl)-(1-methylimidazol-4-yl)methanone (CID 103817135) is (4-hydroxypiperidin-1-yl)-(1-methylimidazol-4-yl)methanone.
What is the SMILES notation for (4-hydroxypiperidin-1-yl)-(1-methylimidazol-4-yl)methanone?
The canonical SMILES for (4-hydroxypiperidin-1-yl)-(1-methylimidazol-4-yl)methanone is Cn1cnc(C(=O)N2CCC(O)CC2)c1.
What is the InChIKey of (4-hydroxypiperidin-1-yl)-(1-methylimidazol-4-yl)methanone?
The InChIKey is LCEGPGZKMLYSRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-12-6-9(11-7-12)10(15)13-4-2-8(14)3-5-13/h6-8,14H,2-5H2,1H3.
What are the key properties of (4-hydroxypiperidin-1-yl)-(1-methylimidazol-4-yl)methanone?
(4-hydroxypiperidin-1-yl)-(1-methylimidazol-4-yl)methanone has a molecular weight of 209.25 g/mol, XLogP of 0.02, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-hydroxypiperidin-1-yl)-(1-methylimidazol-4-yl)methanone is sourced from PubChem (CID 103817135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).