2-[2-[1-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)piperidin-4-yl]imidazol-1-yl]acetamide

C18H21N7O2 — CID 72852161

IUPAC2-[2-[1-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)piperidin-4-yl]imidazol-1-yl]acetamide
SMILESCc1nc2ncccn2c1C(=O)N1CCC(c2nccn2CC(N)=O)CC1
InChIInChI=1S/C18H21N7O2/c1-12-15(25-7-2-5-21-18(25)22-12)17(27)23-8-3-13(4-9-23)16-20-6-10-24(16)11-14(19)26/h2,5-7,10,13H,3-4,8-9,11H2,1H3,(H2,19,26)
InChIKeyVOUOJHQEYIVTAC-UHFFFAOYSA-N
MW367.41 g/mol
LogP0.74
Rot. Bonds4

About 2-[2-[1-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)piperidin-4-yl]imidazol-1-yl]acetamide

2-[2-[1-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)piperidin-4-yl]imidazol-1-yl]acetamide (PubChem CID 72852161) has the molecular formula C18H21N7O2 and a molecular weight of 367.41 g/mol. Its IUPAC name is 2-[2-[1-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)piperidin-4-yl]imidazol-1-yl]acetamide.

Molecular Properties

Compound Name2-[2-[1-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)piperidin-4-yl]imidazol-1-yl]acetamide
PubChem CID72852161
Molecular FormulaC18H21N7O2
Molecular Weight367.41 g/mol
Exact Mass367.18
IUPAC Name2-[2-[1-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)piperidin-4-yl]imidazol-1-yl]acetamide
SMILESCc1nc2ncccn2c1C(=O)N1CCC(c2nccn2CC(N)=O)CC1
InChIInChI=1S/C18H21N7O2/c1-12-15(25-7-2-5-21-18(25)22-12)17(27)23-8-3-13(4-9-23)16-20-6-10-24(16)11-14(19)26/h2,5-7,10,13H,3-4,8-9,11H2,1H3,(H2,19,26)
InChIKeyVOUOJHQEYIVTAC-UHFFFAOYSA-N
XLogP0.74
TPSA111.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(1-ethylpiperidin-4-yl)-5-methyl-8-(4-pyrimidin-2-ylpiperazin-1-yl)imidazo[1,2-a]pyrazine-6-carboxamide
CID 16006945
(2S)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[2-[2-[(2S)-2-(trifluoromethyl)pyrrolidin-1-yl]pyrimidin-5-yl]pyrimidin-4-yl]propanamide
CID 92042878
8-(Imidazo[1,2-a]pyrimidin-2-ylcarbonyl)-2-methyl-2,8-diazaspiro[4.5]decan-3-one
CID 70733536
[3-(3,5-Dimethyl-1,2,4-triazol-1-yl)piperidin-1-yl]-imidazo[1,2-a]pyrimidin-2-ylmethanone
CID 72142750
Imidazo[1,2-a]pyrimidin-2-yl-[3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]methanone
CID 72143150
[3-(2-Ethylimidazol-1-yl)piperidin-1-yl]-imidazo[1,2-a]pyrimidin-2-ylmethanone
CID 72143175
5-[(2-methylimidazo[1,2-a]pyrimidin-3-yl)carbonyl]-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine
CID 72856918
8-(Imidazo[1,2-a]pyrimidin-2-ylcarbonyl)-2-isobutyl-2,8-diazaspiro[4.5]decan-3-one
CID 72930055
4-(Cyclopropylmethyl)-3-isopropyl-1-[(2-methylimidazo[1,2-a]pyrimidin-3-yl)carbonyl]-1,4-diazepan-5-one
CID 56888801
7-Methyl-2-[(2-methylimidazo[1,2-a]pyrimidin-3-yl)carbonyl]-2,7-diazaspiro[4.5]decan-6-one
CID 56902744
N-{[1-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-3-pyrrolidinyl]methyl}imidazo[1,2-a]pyrimidine-2-carboxamide
CID 70717321
3-(2-Ethylbutyl)-8-(imidazo[1,2-a]pyrimidin-2-ylcarbonyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 70724447

Frequently Asked Questions

What is the IUPAC name of 2-[2-[1-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)piperidin-4-yl]imidazol-1-yl]acetamide?
The IUPAC name of 2-[2-[1-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)piperidin-4-yl]imidazol-1-yl]acetamide (CID 72852161) is 2-[2-[1-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)piperidin-4-yl]imidazol-1-yl]acetamide.
What is the SMILES notation for 2-[2-[1-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)piperidin-4-yl]imidazol-1-yl]acetamide?
The canonical SMILES for 2-[2-[1-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)piperidin-4-yl]imidazol-1-yl]acetamide is Cc1nc2ncccn2c1C(=O)N1CCC(c2nccn2CC(N)=O)CC1.
What is the InChIKey of 2-[2-[1-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)piperidin-4-yl]imidazol-1-yl]acetamide?
The InChIKey is VOUOJHQEYIVTAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N7O2/c1-12-15(25-7-2-5-21-18(25)22-12)17(27)23-8-3-13(4-9-23)16-20-6-10-24(16)11-14(19)26/h2,5-7,10,13H,3-4,8-9,11H2,1H3,(H2,19,26).
What are the key properties of 2-[2-[1-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)piperidin-4-yl]imidazol-1-yl]acetamide?
2-[2-[1-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)piperidin-4-yl]imidazol-1-yl]acetamide has a molecular weight of 367.41 g/mol, XLogP of 0.74, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[1-(2-methylimidazo[1,2-a]pyrimidine-3-carbonyl)piperidin-4-yl]imidazol-1-yl]acetamide is sourced from PubChem (CID 72852161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).