6-(2-methylimidazol-1-yl)-3-propan-2-yl-N-[2-(1H-pyrrol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine

C19H23N7 — CID 139399723

IUPAC6-(2-methylimidazol-1-yl)-3-propan-2-yl-N-[2-(1H-pyrrol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine
SMILESCc1nccn1-c1cn2c(C(C)C)cnc2c(NCCc2cc[nH]c2)n1
InChIInChI=1S/C19H23N7/c1-13(2)16-11-23-19-18(22-7-5-15-4-6-20-10-15)24-17(12-26(16)19)25-9-8-21-14(25)3/h4,6,8-13,20H,5,7H2,1-3H3,(H,22,24)
InChIKeyHIPCGBULXCPRIF-UHFFFAOYSA-N
MW349.44 g/mol
LogP3.33
Rot. Bonds6

About 6-(2-methylimidazol-1-yl)-3-propan-2-yl-N-[2-(1H-pyrrol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine

6-(2-methylimidazol-1-yl)-3-propan-2-yl-N-[2-(1H-pyrrol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine (PubChem CID 139399723) has the molecular formula C19H23N7 and a molecular weight of 349.44 g/mol. Its IUPAC name is 6-(2-methylimidazol-1-yl)-3-propan-2-yl-N-[2-(1H-pyrrol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name6-(2-methylimidazol-1-yl)-3-propan-2-yl-N-[2-(1H-pyrrol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine
PubChem CID139399723
Molecular FormulaC19H23N7
Molecular Weight349.44 g/mol
Exact Mass349.20
IUPAC Name6-(2-methylimidazol-1-yl)-3-propan-2-yl-N-[2-(1H-pyrrol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine
SMILESCc1nccn1-c1cn2c(C(C)C)cnc2c(NCCc2cc[nH]c2)n1
InChIInChI=1S/C19H23N7/c1-13(2)16-11-23-19-18(22-7-5-15-4-6-20-10-15)24-17(12-26(16)19)25-9-8-21-14(25)3/h4,6,8-13,20H,5,7H2,1-3H3,(H,22,24)
InChIKeyHIPCGBULXCPRIF-UHFFFAOYSA-N
XLogP3.33
TPSA75.83 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.44
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(2-methylimidazol-1-yl)-3-propan-2-yl-N-[2-(1H-pyrrol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 6-(2-methylimidazol-1-yl)-3-propan-2-yl-N-[2-(1H-pyrrol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine (CID 139399723) is 6-(2-methylimidazol-1-yl)-3-propan-2-yl-N-[2-(1H-pyrrol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 6-(2-methylimidazol-1-yl)-3-propan-2-yl-N-[2-(1H-pyrrol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 6-(2-methylimidazol-1-yl)-3-propan-2-yl-N-[2-(1H-pyrrol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine is Cc1nccn1-c1cn2c(C(C)C)cnc2c(NCCc2cc[nH]c2)n1.
What is the InChIKey of 6-(2-methylimidazol-1-yl)-3-propan-2-yl-N-[2-(1H-pyrrol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is HIPCGBULXCPRIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N7/c1-13(2)16-11-23-19-18(22-7-5-15-4-6-20-10-15)24-17(12-26(16)19)25-9-8-21-14(25)3/h4,6,8-13,20H,5,7H2,1-3H3,(H,22,24).
What are the key properties of 6-(2-methylimidazol-1-yl)-3-propan-2-yl-N-[2-(1H-pyrrol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine?
6-(2-methylimidazol-1-yl)-3-propan-2-yl-N-[2-(1H-pyrrol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 349.44 g/mol, XLogP of 3.33, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methylimidazol-1-yl)-3-propan-2-yl-N-[2-(1H-pyrrol-3-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 139399723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).