5-(4-cyclopropylpiperazin-1-yl)-2-[(6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine

C26H34N6 — CID 155373984

IUPAC5-(4-cyclopropylpiperazin-1-yl)-2-[(6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine
SMILESCc1cccnc1[C@@H]1CCCC(c2cn3c(N4CCN(C5CC5)CC4)cccc3n2)N1C
InChIInChI=1S/C26H34N6/c1-19-6-5-13-27-26(19)23-8-3-7-22(29(23)2)21-18-32-24(28-21)9-4-10-25(32)31-16-14-30(15-17-31)20-11-12-20/h4-6,9-10,13,18,20,22-23H,3,7-8,11-12,14-17H2,1-2H3/t22?,23-/m0/s1
InChIKeyUYUUMQFNLQDNDT-WCSIJFPASA-N
MW430.60 g/mol
LogP4.22
Rot. Bonds4

About 5-(4-cyclopropylpiperazin-1-yl)-2-[(6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine

5-(4-cyclopropylpiperazin-1-yl)-2-[(6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine (PubChem CID 155373984) has the molecular formula C26H34N6 and a molecular weight of 430.60 g/mol. Its IUPAC name is 5-(4-cyclopropylpiperazin-1-yl)-2-[(6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name5-(4-cyclopropylpiperazin-1-yl)-2-[(6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine
PubChem CID155373984
Molecular FormulaC26H34N6
Molecular Weight430.60 g/mol
Exact Mass430.28
IUPAC Name5-(4-cyclopropylpiperazin-1-yl)-2-[(6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine
SMILESCc1cccnc1[C@@H]1CCCC(c2cn3c(N4CCN(C5CC5)CC4)cccc3n2)N1C
InChIInChI=1S/C26H34N6/c1-19-6-5-13-27-26(19)23-8-3-7-22(29(23)2)21-18-32-24(28-21)9-4-10-25(32)31-16-14-30(15-17-31)20-11-12-20/h4-6,9-10,13,18,20,22-23H,3,7-8,11-12,14-17H2,1-2H3/t22?,23-/m0/s1
InChIKeyUYUUMQFNLQDNDT-WCSIJFPASA-N
XLogP4.22
TPSA39.91 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.60
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(4-cyclopropylpiperazin-1-yl)-2-[(6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine?
The IUPAC name of 5-(4-cyclopropylpiperazin-1-yl)-2-[(6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine (CID 155373984) is 5-(4-cyclopropylpiperazin-1-yl)-2-[(6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 5-(4-cyclopropylpiperazin-1-yl)-2-[(6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine?
The canonical SMILES for 5-(4-cyclopropylpiperazin-1-yl)-2-[(6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine is Cc1cccnc1[C@@H]1CCCC(c2cn3c(N4CCN(C5CC5)CC4)cccc3n2)N1C.
What is the InChIKey of 5-(4-cyclopropylpiperazin-1-yl)-2-[(6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine?
The InChIKey is UYUUMQFNLQDNDT-WCSIJFPASA-N. The full InChI is InChI=1S/C26H34N6/c1-19-6-5-13-27-26(19)23-8-3-7-22(29(23)2)21-18-32-24(28-21)9-4-10-25(32)31-16-14-30(15-17-31)20-11-12-20/h4-6,9-10,13,18,20,22-23H,3,7-8,11-12,14-17H2,1-2H3/t22?,23-/m0/s1.
What are the key properties of 5-(4-cyclopropylpiperazin-1-yl)-2-[(6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine?
5-(4-cyclopropylpiperazin-1-yl)-2-[(6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine has a molecular weight of 430.60 g/mol, XLogP of 4.22, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-cyclopropylpiperazin-1-yl)-2-[(6S)-1-methyl-6-(3-methyl-2-pyridinyl)piperidin-2-yl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 155373984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).