N-ethyl-4-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-6-methylpyrimidin-2-amine

C19H25N7 — CID 155800877

IUPACN-ethyl-4-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-6-methylpyrimidin-2-amine
SMILESCCNc1nc(C)cc(N2CCN(Cc3cn4ccccc4n3)CC2)n1
InChIInChI=1S/C19H25N7/c1-3-20-19-21-15(2)12-18(23-19)25-10-8-24(9-11-25)13-16-14-26-7-5-4-6-17(26)22-16/h4-7,12,14H,3,8-11,13H2,1-2H3,(H,20,21,23)
InChIKeyFGNKBVVWKYCMMV-UHFFFAOYSA-N
MW351.46 g/mol
LogP2.19
Rot. Bonds5

About N-ethyl-4-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-6-methylpyrimidin-2-amine

N-ethyl-4-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-6-methylpyrimidin-2-amine (PubChem CID 155800877) has the molecular formula C19H25N7 and a molecular weight of 351.46 g/mol. Its IUPAC name is N-ethyl-4-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-6-methylpyrimidin-2-amine.

Molecular Properties

Compound NameN-ethyl-4-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-6-methylpyrimidin-2-amine
PubChem CID155800877
Molecular FormulaC19H25N7
Molecular Weight351.46 g/mol
Exact Mass351.22
IUPAC NameN-ethyl-4-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-6-methylpyrimidin-2-amine
SMILESCCNc1nc(C)cc(N2CCN(Cc3cn4ccccc4n3)CC2)n1
InChIInChI=1S/C19H25N7/c1-3-20-19-21-15(2)12-18(23-19)25-10-8-24(9-11-25)13-16-14-26-7-5-4-6-17(26)22-16/h4-7,12,14H,3,8-11,13H2,1-2H3,(H,20,21,23)
InChIKeyFGNKBVVWKYCMMV-UHFFFAOYSA-N
XLogP2.19
TPSA61.59 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.46
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-6-methylpyrimidin-2-amine?
The IUPAC name of N-ethyl-4-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-6-methylpyrimidin-2-amine (CID 155800877) is N-ethyl-4-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-6-methylpyrimidin-2-amine.
What is the SMILES notation for N-ethyl-4-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-6-methylpyrimidin-2-amine?
The canonical SMILES for N-ethyl-4-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-6-methylpyrimidin-2-amine is CCNc1nc(C)cc(N2CCN(Cc3cn4ccccc4n3)CC2)n1.
What is the InChIKey of N-ethyl-4-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-6-methylpyrimidin-2-amine?
The InChIKey is FGNKBVVWKYCMMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N7/c1-3-20-19-21-15(2)12-18(23-19)25-10-8-24(9-11-25)13-16-14-26-7-5-4-6-17(26)22-16/h4-7,12,14H,3,8-11,13H2,1-2H3,(H,20,21,23).
What are the key properties of N-ethyl-4-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-6-methylpyrimidin-2-amine?
N-ethyl-4-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-6-methylpyrimidin-2-amine has a molecular weight of 351.46 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-6-methylpyrimidin-2-amine is sourced from PubChem (CID 155800877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).