4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)-N-(4-methylphenyl)piperazine-1-carboxamide

C20H26N6O — CID 53184321

IUPAC4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)-N-(4-methylphenyl)piperazine-1-carboxamide
SMILESCCC1CN2C=NC(N3CCN(C(=O)Nc4ccc(C)cc4)CC3)=CC2=N1
InChIInChI=1S/C20H26N6O/c1-3-16-13-26-14-21-18(12-19(26)22-16)24-8-10-25(11-9-24)20(27)23-17-6-4-15(2)5-7-17/h4-7,12,14,16H,3,8-11,13H2,1-2H3,(H,23,27)
InChIKeyWLPFKVREVYALFU-UHFFFAOYSA-N
MW366.47 g/mol
LogP2.52
Rot. Bonds3

About 4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)-N-(4-methylphenyl)piperazine-1-carboxamide

4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)-N-(4-methylphenyl)piperazine-1-carboxamide (PubChem CID 53184321) has the molecular formula C20H26N6O and a molecular weight of 366.47 g/mol. Its IUPAC name is 4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)-N-(4-methylphenyl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)-N-(4-methylphenyl)piperazine-1-carboxamide
PubChem CID53184321
Molecular FormulaC20H26N6O
Molecular Weight366.47 g/mol
Exact Mass366.22
IUPAC Name4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)-N-(4-methylphenyl)piperazine-1-carboxamide
SMILESCCC1CN2C=NC(N3CCN(C(=O)Nc4ccc(C)cc4)CC3)=CC2=N1
InChIInChI=1S/C20H26N6O/c1-3-16-13-26-14-21-18(12-19(26)22-16)24-8-10-25(11-9-24)20(27)23-17-6-4-15(2)5-7-17/h4-7,12,14,16H,3,8-11,13H2,1-2H3,(H,23,27)
InChIKeyWLPFKVREVYALFU-UHFFFAOYSA-N
XLogP2.52
TPSA63.54 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.47
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)-N-(4-methylphenyl)piperazine-1-carboxamide?
The IUPAC name of 4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)-N-(4-methylphenyl)piperazine-1-carboxamide (CID 53184321) is 4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)-N-(4-methylphenyl)piperazine-1-carboxamide.
What is the SMILES notation for 4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)-N-(4-methylphenyl)piperazine-1-carboxamide?
The canonical SMILES for 4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)-N-(4-methylphenyl)piperazine-1-carboxamide is CCC1CN2C=NC(N3CCN(C(=O)Nc4ccc(C)cc4)CC3)=CC2=N1.
What is the InChIKey of 4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)-N-(4-methylphenyl)piperazine-1-carboxamide?
The InChIKey is WLPFKVREVYALFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N6O/c1-3-16-13-26-14-21-18(12-19(26)22-16)24-8-10-25(11-9-24)20(27)23-17-6-4-15(2)5-7-17/h4-7,12,14,16H,3,8-11,13H2,1-2H3,(H,23,27).
What are the key properties of 4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)-N-(4-methylphenyl)piperazine-1-carboxamide?
4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)-N-(4-methylphenyl)piperazine-1-carboxamide has a molecular weight of 366.47 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)-N-(4-methylphenyl)piperazine-1-carboxamide is sourced from PubChem (CID 53184321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).