2-[(3-butan-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine

C16H24N4 — CID 64831720

IUPAC2-[(3-butan-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine
SMILESCCC(C)C1CN(Cc2cn3ccccc3n2)CCN1
InChIInChI=1S/C16H24N4/c1-3-13(2)15-12-19(9-7-17-15)10-14-11-20-8-5-4-6-16(20)18-14/h4-6,8,11,13,15,17H,3,7,9-10,12H2,1-2H3
InChIKeyDMMGKEKVDRFZGY-UHFFFAOYSA-N
MW272.40 g/mol
LogP2.15
Rot. Bonds4

About 2-[(3-butan-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine

2-[(3-butan-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine (PubChem CID 64831720) has the molecular formula C16H24N4 and a molecular weight of 272.40 g/mol. Its IUPAC name is 2-[(3-butan-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-[(3-butan-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine
PubChem CID64831720
Molecular FormulaC16H24N4
Molecular Weight272.40 g/mol
Exact Mass272.20
IUPAC Name2-[(3-butan-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine
SMILESCCC(C)C1CN(Cc2cn3ccccc3n2)CCN1
InChIInChI=1S/C16H24N4/c1-3-13(2)15-12-19(9-7-17-15)10-14-11-20-8-5-4-6-16(20)18-14/h4-6,8,11,13,15,17H,3,7,9-10,12H2,1-2H3
InChIKeyDMMGKEKVDRFZGY-UHFFFAOYSA-N
XLogP2.15
TPSA32.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.40
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(3-ethylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine
CID 64833998
2-[(3-methyl-1,4-diazepan-1-yl)methyl]imidazo[1,2-a]pyridine
CID 64859024
2-[[4-(2-methylpropyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 45366493
3-[(3-butan-2-ylpiperazin-1-yl)methyl]pyridazine
CID 106897929
2-[(7-methyl-3-propan-2-yl-1,4-diazepan-1-yl)methyl]imidazo[1,2-a]pyridine
CID 64870552
1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidin-3-ol
CID 62918360
2-[[4-(1-phenylethyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 134011284
1-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-3-piperidin-4-ylbutan-1-one;dihydrochloride
CID 119837429
2-[(3-ethyl-3-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine
CID 64834447
2-[(3-bromopyrrolidin-1-yl)methyl]imidazo[1,2-a]pyridine
CID 80677191
1-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)morpholin-2-yl]ethanamine
CID 115314933
1-[2-(3-butan-2-ylpiperazin-1-yl)ethyl]pyridin-2-one
CID 82907056

Frequently Asked Questions

What is the IUPAC name of 2-[(3-butan-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine?
The IUPAC name of 2-[(3-butan-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine (CID 64831720) is 2-[(3-butan-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 2-[(3-butan-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 2-[(3-butan-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine is CCC(C)C1CN(Cc2cn3ccccc3n2)CCN1.
What is the InChIKey of 2-[(3-butan-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine?
The InChIKey is DMMGKEKVDRFZGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4/c1-3-13(2)15-12-19(9-7-17-15)10-14-11-20-8-5-4-6-16(20)18-14/h4-6,8,11,13,15,17H,3,7,9-10,12H2,1-2H3.
What are the key properties of 2-[(3-butan-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine?
2-[(3-butan-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine has a molecular weight of 272.40 g/mol, XLogP of 2.15, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-butan-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 64831720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).