7-[(2S)-1-(1H-pyrazol-5-ylmethyl)piperidin-2-yl]imidazo[1,2-a]pyrimidine

C15H18N6 — CID 125007862

IUPAC7-[(2S)-1-(1H-pyrazol-5-ylmethyl)piperidin-2-yl]imidazo[1,2-a]pyrimidine
SMILESc1cc(CN2CCCC[C@H]2c2ccn3ccnc3n2)[nH]n1
InChIInChI=1S/C15H18N6/c1-2-8-21(11-12-4-6-17-19-12)14(3-1)13-5-9-20-10-7-16-15(20)18-13/h4-7,9-10,14H,1-3,8,11H2,(H,17,19)/t14-/m0/s1
InChIKeyUQSZYHWJCKCGDJ-AWEZNQCLSA-N
MW282.35 g/mol
LogP2.18
Rot. Bonds3

About 7-[(2S)-1-(1H-pyrazol-5-ylmethyl)piperidin-2-yl]imidazo[1,2-a]pyrimidine

7-[(2S)-1-(1H-pyrazol-5-ylmethyl)piperidin-2-yl]imidazo[1,2-a]pyrimidine (PubChem CID 125007862) has the molecular formula C15H18N6 and a molecular weight of 282.35 g/mol. Its IUPAC name is 7-[(2S)-1-(1H-pyrazol-5-ylmethyl)piperidin-2-yl]imidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name7-[(2S)-1-(1H-pyrazol-5-ylmethyl)piperidin-2-yl]imidazo[1,2-a]pyrimidine
PubChem CID125007862
Molecular FormulaC15H18N6
Molecular Weight282.35 g/mol
Exact Mass282.16
IUPAC Name7-[(2S)-1-(1H-pyrazol-5-ylmethyl)piperidin-2-yl]imidazo[1,2-a]pyrimidine
SMILESc1cc(CN2CCCC[C@H]2c2ccn3ccnc3n2)[nH]n1
InChIInChI=1S/C15H18N6/c1-2-8-21(11-12-4-6-17-19-12)14(3-1)13-5-9-20-10-7-16-15(20)18-13/h4-7,9-10,14H,1-3,8,11H2,(H,17,19)/t14-/m0/s1
InChIKeyUQSZYHWJCKCGDJ-AWEZNQCLSA-N
XLogP2.18
TPSA62.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(2-imidazo[1,2-a]pyrimidin-7-ylpiperidin-1-yl)methyl]-1,3-thiazole
CID 110118108
2-[[(2R)-2-imidazo[1,2-a]pyrimidin-7-ylpiperidin-1-yl]methyl]-1,3-thiazole
CID 124962159
7-[(2S)-1-[(5-chloro-2-pyridinyl)methyl]piperidin-2-yl]imidazo[1,2-a]pyrimidine
CID 124944000
2-methyl-6-[(2R)-1-(1H-pyrazol-5-ylmethyl)piperidin-2-yl]-N-pyridin-2-ylpyrimidin-4-amine
CID 124998938
5-[[(2S)-2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]-1H-pyrazole
CID 124591281
2-[[(2R)-2-(1H-pyrazol-5-yl)piperidin-1-yl]methyl]-1,3-thiazole
CID 124641351
(5-tert-butyl-1H-pyrazol-3-yl)-[(2R)-2-imidazo[1,2-a]pyrimidin-7-ylpiperidin-1-yl]methanone
CID 124963028
2-[2-[(2R)-1-(1H-pyrazol-5-ylmethyl)piperidin-2-yl]ethyl]pyridine
CID 29214676
1-[(2R)-2-imidazo[1,2-a]pyrimidin-7-ylpiperidin-1-yl]-2-thiophen-2-ylethanone
CID 124970271
3-[1-(1H-pyrazol-5-ylmethyl)piperidin-2-yl]pyridine;bis(2,2,2-trifluoroacetic acid)
CID 154891173
(8aR)-2-(1H-pyrazol-5-ylmethyl)-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridine-1,3-dione
CID 99781573
5-ethyl-N-[2-methyl-6-[1-(1H-pyrazol-5-ylmethyl)pyrrolidin-2-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine
CID 110111894

Frequently Asked Questions

What is the IUPAC name of 7-[(2S)-1-(1H-pyrazol-5-ylmethyl)piperidin-2-yl]imidazo[1,2-a]pyrimidine?
The IUPAC name of 7-[(2S)-1-(1H-pyrazol-5-ylmethyl)piperidin-2-yl]imidazo[1,2-a]pyrimidine (CID 125007862) is 7-[(2S)-1-(1H-pyrazol-5-ylmethyl)piperidin-2-yl]imidazo[1,2-a]pyrimidine.
What is the SMILES notation for 7-[(2S)-1-(1H-pyrazol-5-ylmethyl)piperidin-2-yl]imidazo[1,2-a]pyrimidine?
The canonical SMILES for 7-[(2S)-1-(1H-pyrazol-5-ylmethyl)piperidin-2-yl]imidazo[1,2-a]pyrimidine is c1cc(CN2CCCC[C@H]2c2ccn3ccnc3n2)[nH]n1.
What is the InChIKey of 7-[(2S)-1-(1H-pyrazol-5-ylmethyl)piperidin-2-yl]imidazo[1,2-a]pyrimidine?
The InChIKey is UQSZYHWJCKCGDJ-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H18N6/c1-2-8-21(11-12-4-6-17-19-12)14(3-1)13-5-9-20-10-7-16-15(20)18-13/h4-7,9-10,14H,1-3,8,11H2,(H,17,19)/t14-/m0/s1.
What are the key properties of 7-[(2S)-1-(1H-pyrazol-5-ylmethyl)piperidin-2-yl]imidazo[1,2-a]pyrimidine?
7-[(2S)-1-(1H-pyrazol-5-ylmethyl)piperidin-2-yl]imidazo[1,2-a]pyrimidine has a molecular weight of 282.35 g/mol, XLogP of 2.18, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(2S)-1-(1H-pyrazol-5-ylmethyl)piperidin-2-yl]imidazo[1,2-a]pyrimidine is sourced from PubChem (CID 125007862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).