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

C19H22F2N6O — CID 53184330

IUPACN-(2,4-difluorophenyl)-4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide
SMILESCCC1CN2C=NC(N3CCN(C(=O)Nc4ccc(F)cc4F)CC3)=CC2=N1
InChIInChI=1S/C19H22F2N6O/c1-2-14-11-27-12-22-17(10-18(27)23-14)25-5-7-26(8-6-25)19(28)24-16-4-3-13(20)9-15(16)21/h3-4,9-10,12,14H,2,5-8,11H2,1H3,(H,24,28)
InChIKeySICXGFQXSNLUII-UHFFFAOYSA-N
MW388.42 g/mol
LogP2.49
Rot. Bonds3

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

N-(2,4-difluorophenyl)-4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide (PubChem CID 53184330) has the molecular formula C19H22F2N6O and a molecular weight of 388.42 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide
PubChem CID53184330
Molecular FormulaC19H22F2N6O
Molecular Weight388.42 g/mol
Exact Mass388.18
IUPAC NameN-(2,4-difluorophenyl)-4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide
SMILESCCC1CN2C=NC(N3CCN(C(=O)Nc4ccc(F)cc4F)CC3)=CC2=N1
InChIInChI=1S/C19H22F2N6O/c1-2-14-11-27-12-22-17(10-18(27)23-14)25-5-7-26(8-6-25)19(28)24-16-4-3-13(20)9-15(16)21/h3-4,9-10,12,14H,2,5-8,11H2,1H3,(H,24,28)
InChIKeySICXGFQXSNLUII-UHFFFAOYSA-N
XLogP2.49
TPSA63.54 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.42
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,4-difluorophenyl)-4-[(2R)-2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl]piperazine-1-carboxamide
CID 95106457
(5-chlorothiophen-2-yl)-[4-[(2R)-2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl]piperazin-1-yl]methanone
CID 95106525
N-(2-methoxyphenyl)-4-(2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide
CID 53184257
N-(4-methoxy-2-methylphenyl)-4-(2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide
CID 53184276
N-(2,4-difluorophenyl)-4-(2-methyl-6-pyrrolidin-1-ylpyrimidin-4-yl)piperazine-1-carboxamide
CID 56919621
1-[(2,4-difluorophenyl)carbamoyl]piperidine-4-carboxylic acid
CID 16770140
4-(4-tert-butylphenyl)-N-(2,4-difluorophenyl)piperazine-1-carboxamide
CID 113112680
N-(2,4-difluorophenyl)-3-ethyl-4-oxopiperidine-1-carboxamide
CID 114508450
N-(2,4-difluorophenyl)-4-(6-methyl-2-piperidin-1-ylpyrimidin-4-yl)piperazine-1-carboxamide
CID 56699290
N-(2,3-dihydro-1H-inden-5-yl)-4-(2-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide
CID 53184272
4-(2-aminoethyl)-N-(2,4-difluorophenyl)piperidine-1-carboxamide
CID 56773384
N-(2,4-difluorophenyl)-4-(1-methylbenzimidazol-2-yl)piperazine-1-carboxamide
CID 46375509

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide?
The IUPAC name of N-(2,4-difluorophenyl)-4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide (CID 53184330) is N-(2,4-difluorophenyl)-4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide?
The canonical SMILES for N-(2,4-difluorophenyl)-4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide is CCC1CN2C=NC(N3CCN(C(=O)Nc4ccc(F)cc4F)CC3)=CC2=N1.
What is the InChIKey of N-(2,4-difluorophenyl)-4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide?
The InChIKey is SICXGFQXSNLUII-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22F2N6O/c1-2-14-11-27-12-22-17(10-18(27)23-14)25-5-7-26(8-6-25)19(28)24-16-4-3-13(20)9-15(16)21/h3-4,9-10,12,14H,2,5-8,11H2,1H3,(H,24,28).
What are the key properties of N-(2,4-difluorophenyl)-4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide?
N-(2,4-difluorophenyl)-4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide has a molecular weight of 388.42 g/mol, XLogP of 2.49, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-4-(2-ethyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazine-1-carboxamide is sourced from PubChem (CID 53184330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).