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

C20H26N6O2 — CID 53184266

IUPACN-[(3-methoxyphenyl)methyl]-4-(2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide
SMILESCOc1cccc(CNC(=O)N2CCN(C3=CC4=NC(C)CN4C=N3)CC2)c1
InChIInChI=1S/C20H26N6O2/c1-15-13-26-14-22-18(11-19(26)23-15)24-6-8-25(9-7-24)20(27)21-12-16-4-3-5-17(10-16)28-2/h3-5,10-11,14-15H,6-9,12-13H2,1-2H3,(H,21,27)
InChIKeyPFVGPQYHYNPGEG-UHFFFAOYSA-N
MW382.47 g/mol
LogP1.51
Rot. Bonds4

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

N-[(3-methoxyphenyl)methyl]-4-(2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide (PubChem CID 53184266) has the molecular formula C20H26N6O2 and a molecular weight of 382.47 g/mol. Its IUPAC name is N-[(3-methoxyphenyl)methyl]-4-(2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-[(3-methoxyphenyl)methyl]-4-(2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide
PubChem CID53184266
Molecular FormulaC20H26N6O2
Molecular Weight382.47 g/mol
Exact Mass382.21
IUPAC NameN-[(3-methoxyphenyl)methyl]-4-(2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide
SMILESCOc1cccc(CNC(=O)N2CCN(C3=CC4=NC(C)CN4C=N3)CC2)c1
InChIInChI=1S/C20H26N6O2/c1-15-13-26-14-22-18(11-19(26)23-15)24-6-8-25(9-7-24)20(27)21-12-16-4-3-5-17(10-16)28-2/h3-5,10-11,14-15H,6-9,12-13H2,1-2H3,(H,21,27)
InChIKeyPFVGPQYHYNPGEG-UHFFFAOYSA-N
XLogP1.51
TPSA72.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.47
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-[1-(3-Methoxy-benzyl)-piperidin-4-yl]-5-methyl-4-phenyl-1,3-dihydro-imidazol-2-one
CID 10547607
2-(4,5-dihydro-1H-imidazol-2-yl)-1-[(3-methoxyphenyl)methyl]-4-methylpiperazine
CID 10565313
4-[(Z)-[7-cyclopropylimino-5-[[(1S)-1-(3-methoxyphenyl)ethyl]amino]pyrazolo[1,5-a]pyrimidin-3-ylidene]methyl]-5-hydroxy-1,3-dihydroimidazol-2-one
CID 136484260
4-{3-[(4-Fluorophenyl)methyl]-2-oxoimidazolidin-1-YL}-N-[(3-methoxyphenyl)methyl]piperidine-1-carboxamide
CID 53098500
N~1~-1H-benzimidazol-2-yl-N~2~-(2-thienylcarbonyl)norvalinamide
CID 46381828
N-[(3-Methoxyphenyl)methyl]-4-{3-[(4-methylphenyl)methyl]-2-oxoimidazolidin-1-YL}piperidine-1-carboxamide
CID 53098558
4-(3-benzyl-2-oxoimidazolidin-1-yl)-N-(3-methoxybenzyl)piperidine-1-carboxamide
CID 53098620
N-(3-methoxybenzyl)-9-oxo-5,7,8,9-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidine-6(1H)-carboxamide
CID 53183831
N-(3-methoxybenzyl)-9-oxo-2-phenyl-5,7,8,9-tetrahydropyrazolo[1,5-a]pyrido[3,4-d]pyrimidine-6(1H)-carboxamide
CID 53183885
3-(3-Methoxyphenyl)-1-[4-(3-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazino]-1-propanone
CID 53184222
"N-(4-methoxy-2-methylphenyl)-4-(3-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)tetrahydro-1(2H)-pyrazinecarboxamide"
CID 53184247
N-[(4-Methoxyphenyl)methyl]-4-{2-methyl-2H,3H-imidazo[1,2-C]pyrimidin-7-YL}piperazine-1-carboxamide
CID 53184270

Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxyphenyl)methyl]-4-(2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide?
The IUPAC name of N-[(3-methoxyphenyl)methyl]-4-(2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide (CID 53184266) is N-[(3-methoxyphenyl)methyl]-4-(2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide.
What is the SMILES notation for N-[(3-methoxyphenyl)methyl]-4-(2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide?
The canonical SMILES for N-[(3-methoxyphenyl)methyl]-4-(2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide is COc1cccc(CNC(=O)N2CCN(C3=CC4=NC(C)CN4C=N3)CC2)c1.
What is the InChIKey of N-[(3-methoxyphenyl)methyl]-4-(2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide?
The InChIKey is PFVGPQYHYNPGEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N6O2/c1-15-13-26-14-22-18(11-19(26)23-15)24-6-8-25(9-7-24)20(27)21-12-16-4-3-5-17(10-16)28-2/h3-5,10-11,14-15H,6-9,12-13H2,1-2H3,(H,21,27).
What are the key properties of N-[(3-methoxyphenyl)methyl]-4-(2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide?
N-[(3-methoxyphenyl)methyl]-4-(2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide has a molecular weight of 382.47 g/mol, XLogP of 1.51, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxyphenyl)methyl]-4-(2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide is sourced from PubChem (CID 53184266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).