4-(4-methyl-2-pyridinyl)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethyl)piperazine-1-carboxamide

C19H26N6O — CID 127626668

IUPAC4-(4-methyl-2-pyridinyl)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethyl)piperazine-1-carboxamide
SMILESCc1ccnc(N2CCN(C(=O)NCC3CCCn4ccnc43)CC2)c1
InChIInChI=1S/C19H26N6O/c1-15-4-5-20-17(13-15)23-9-11-25(12-10-23)19(26)22-14-16-3-2-7-24-8-6-21-18(16)24/h4-6,8,13,16H,2-3,7,9-12,14H2,1H3,(H,22,26)
InChIKeyGRUWKRVAEBUUAO-UHFFFAOYSA-N
MW354.46 g/mol
LogP2.00
Rot. Bonds3

About 4-(4-methyl-2-pyridinyl)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethyl)piperazine-1-carboxamide

4-(4-methyl-2-pyridinyl)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethyl)piperazine-1-carboxamide (PubChem CID 127626668) has the molecular formula C19H26N6O and a molecular weight of 354.46 g/mol. Its IUPAC name is 4-(4-methyl-2-pyridinyl)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethyl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(4-methyl-2-pyridinyl)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethyl)piperazine-1-carboxamide
PubChem CID127626668
Molecular FormulaC19H26N6O
Molecular Weight354.46 g/mol
Exact Mass354.22
IUPAC Name4-(4-methyl-2-pyridinyl)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethyl)piperazine-1-carboxamide
SMILESCc1ccnc(N2CCN(C(=O)NCC3CCCn4ccnc43)CC2)c1
InChIInChI=1S/C19H26N6O/c1-15-4-5-20-17(13-15)23-9-11-25(12-10-23)19(26)22-14-16-3-2-7-24-8-6-21-18(16)24/h4-6,8,13,16H,2-3,7,9-12,14H2,1H3,(H,22,26)
InChIKeyGRUWKRVAEBUUAO-UHFFFAOYSA-N
XLogP2.00
TPSA66.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.46
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(4-methyl-2-pyridinyl)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethyl)piperazine-1-carboxamide?
The IUPAC name of 4-(4-methyl-2-pyridinyl)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethyl)piperazine-1-carboxamide (CID 127626668) is 4-(4-methyl-2-pyridinyl)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethyl)piperazine-1-carboxamide.
What is the SMILES notation for 4-(4-methyl-2-pyridinyl)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethyl)piperazine-1-carboxamide?
The canonical SMILES for 4-(4-methyl-2-pyridinyl)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethyl)piperazine-1-carboxamide is Cc1ccnc(N2CCN(C(=O)NCC3CCCn4ccnc43)CC2)c1.
What is the InChIKey of 4-(4-methyl-2-pyridinyl)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethyl)piperazine-1-carboxamide?
The InChIKey is GRUWKRVAEBUUAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N6O/c1-15-4-5-20-17(13-15)23-9-11-25(12-10-23)19(26)22-14-16-3-2-7-24-8-6-21-18(16)24/h4-6,8,13,16H,2-3,7,9-12,14H2,1H3,(H,22,26).
What are the key properties of 4-(4-methyl-2-pyridinyl)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethyl)piperazine-1-carboxamide?
4-(4-methyl-2-pyridinyl)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethyl)piperazine-1-carboxamide has a molecular weight of 354.46 g/mol, XLogP of 2.00, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methyl-2-pyridinyl)-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethyl)piperazine-1-carboxamide is sourced from PubChem (CID 127626668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).