7-piperazin-1-yl-2-(piperidin-3-ylmethyl)imidazo[1,2-a]pyridine

C17H25N5 — CID 117236368

IUPAC7-piperazin-1-yl-2-(piperidin-3-ylmethyl)imidazo[1,2-a]pyridine
SMILESc1cn2cc(CC3CCCNC3)nc2cc1N1CCNCC1
InChIInChI=1S/C17H25N5/c1-2-14(12-19-4-1)10-15-13-22-7-3-16(11-17(22)20-15)21-8-5-18-6-9-21/h3,7,11,13-14,18-19H,1-2,4-6,8-10,12H2
InChIKeyCVVCOBMRULPVIX-UHFFFAOYSA-N
MW299.42 g/mol
LogP1.29
Rot. Bonds3

About 7-piperazin-1-yl-2-(piperidin-3-ylmethyl)imidazo[1,2-a]pyridine

7-piperazin-1-yl-2-(piperidin-3-ylmethyl)imidazo[1,2-a]pyridine (PubChem CID 117236368) has the molecular formula C17H25N5 and a molecular weight of 299.42 g/mol. Its IUPAC name is 7-piperazin-1-yl-2-(piperidin-3-ylmethyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name7-piperazin-1-yl-2-(piperidin-3-ylmethyl)imidazo[1,2-a]pyridine
PubChem CID117236368
Molecular FormulaC17H25N5
Molecular Weight299.42 g/mol
Exact Mass299.21
IUPAC Name7-piperazin-1-yl-2-(piperidin-3-ylmethyl)imidazo[1,2-a]pyridine
SMILESc1cn2cc(CC3CCCNC3)nc2cc1N1CCNCC1
InChIInChI=1S/C17H25N5/c1-2-14(12-19-4-1)10-15-13-22-7-3-16(11-17(22)20-15)21-8-5-18-6-9-21/h3,7,11,13-14,18-19H,1-2,4-6,8-10,12H2
InChIKeyCVVCOBMRULPVIX-UHFFFAOYSA-N
XLogP1.29
TPSA44.60 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.42
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

7-piperazin-1-yl-2-(thian-4-ylmethyl)imidazo[1,2-a]pyridine
CID 117236324
[2-(pyrrolidin-3-ylmethyl)imidazo[1,2-a]pyridin-7-yl]methanamine
CID 117133738
3-(7-piperazin-1-ylimidazo[1,2-a]pyridin-2-yl)propan-1-ol
CID 117236286
2-(pyrrolidin-3-ylmethyl)imidazo[1,2-a]pyridine-7-carboxylic acid
CID 117133831
2-[(4-methylphenyl)methyl]-7-piperazin-1-ylimidazo[1,2-a]pyridine
CID 117236404
6-methoxy-2-(piperidin-3-ylmethyl)imidazo[1,2-a]pyridine
CID 117130028
7-piperazin-1-yl-2-(thian-4-yl)imidazo[1,2-a]pyridine
CID 117236308
7-fluoro-2-(piperidin-3-ylmethyl)pyrido[1,2-a]pyrimidin-4-one
CID 115054690
2-[[(3R)-piperidin-3-yl]methyl]-6-pyrrolidin-1-ylpyridine
CID 95846194
2-(piperidin-3-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
CID 117154255
2-(2-methylphenyl)-7-piperazin-1-ylimidazo[1,2-a]pyridine
CID 117236435
2-[(1-methylpyrrolidin-3-yl)methyl]imidazo[1,2-a]pyridin-7-amine
CID 117133789

Frequently Asked Questions

What is the IUPAC name of 7-piperazin-1-yl-2-(piperidin-3-ylmethyl)imidazo[1,2-a]pyridine?
The IUPAC name of 7-piperazin-1-yl-2-(piperidin-3-ylmethyl)imidazo[1,2-a]pyridine (CID 117236368) is 7-piperazin-1-yl-2-(piperidin-3-ylmethyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 7-piperazin-1-yl-2-(piperidin-3-ylmethyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 7-piperazin-1-yl-2-(piperidin-3-ylmethyl)imidazo[1,2-a]pyridine is c1cn2cc(CC3CCCNC3)nc2cc1N1CCNCC1.
What is the InChIKey of 7-piperazin-1-yl-2-(piperidin-3-ylmethyl)imidazo[1,2-a]pyridine?
The InChIKey is CVVCOBMRULPVIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N5/c1-2-14(12-19-4-1)10-15-13-22-7-3-16(11-17(22)20-15)21-8-5-18-6-9-21/h3,7,11,13-14,18-19H,1-2,4-6,8-10,12H2.
What are the key properties of 7-piperazin-1-yl-2-(piperidin-3-ylmethyl)imidazo[1,2-a]pyridine?
7-piperazin-1-yl-2-(piperidin-3-ylmethyl)imidazo[1,2-a]pyridine has a molecular weight of 299.42 g/mol, XLogP of 1.29, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-piperazin-1-yl-2-(piperidin-3-ylmethyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 117236368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).