(8R)-8-methyl-N-propan-2-yl-7-(quinolin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide

C21H25N5O — CID 124806170

IUPAC(8R)-8-methyl-N-propan-2-yl-7-(quinolin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
SMILESCC(C)NC(=O)c1cn2c(n1)[C@@H](C)N(Cc1ccc3ccccc3n1)CC2
InChIInChI=1S/C21H25N5O/c1-14(2)22-21(27)19-13-26-11-10-25(15(3)20(26)24-19)12-17-9-8-16-6-4-5-7-18(16)23-17/h4-9,13-15H,10-12H2,1-3H3,(H,22,27)/t15-/m1/s1
InChIKeyNFEDQJVCUIJYMM-OAHLLOKOSA-N
MW363.47 g/mol
LogP3.15
Rot. Bonds4

About (8R)-8-methyl-N-propan-2-yl-7-(quinolin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide

(8R)-8-methyl-N-propan-2-yl-7-(quinolin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide (PubChem CID 124806170) has the molecular formula C21H25N5O and a molecular weight of 363.47 g/mol. Its IUPAC name is (8R)-8-methyl-N-propan-2-yl-7-(quinolin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide.

Molecular Properties

Compound Name(8R)-8-methyl-N-propan-2-yl-7-(quinolin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
PubChem CID124806170
Molecular FormulaC21H25N5O
Molecular Weight363.47 g/mol
Exact Mass363.21
IUPAC Name(8R)-8-methyl-N-propan-2-yl-7-(quinolin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
SMILESCC(C)NC(=O)c1cn2c(n1)[C@@H](C)N(Cc1ccc3ccccc3n1)CC2
InChIInChI=1S/C21H25N5O/c1-14(2)22-21(27)19-13-26-11-10-25(15(3)20(26)24-19)12-17-9-8-16-6-4-5-7-18(16)23-17/h4-9,13-15H,10-12H2,1-3H3,(H,22,27)/t15-/m1/s1
InChIKeyNFEDQJVCUIJYMM-OAHLLOKOSA-N
XLogP3.15
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.47
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(8S)-8-methyl-N-propan-2-yl-7-(pyridin-3-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
CID 124809087
8-methyl-N-propan-2-yl-7-(pyridin-3-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;bis(2,2,2-trifluoroacetic acid)
CID 155862125
(8S)-8-methyl-N-propan-2-yl-7-pyrimidin-2-yl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
CID 124803493
1-[1-(quinolin-2-ylmethyl)piperidin-2-yl]propan-2-one
CID 79538611
[(2S)-1-(quinolin-2-ylmethyl)pyrrolidin-2-yl]methanol
CID 78995603
N-(cyclopropylmethyl)-8-methyl-7-(thiophen-3-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide;2,2,2-trifluoroacetic acid
CID 155863880
(8S)-7-(furan-3-ylmethyl)-N,N,8-trimethyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
CID 124809787
2-[8-methyl-7-[(3-methylthiophen-2-yl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-N-propan-2-ylacetamide;2,2,2-trifluoroacetic acid
CID 155832006
N,N,8-trimethyl-7-(thiophen-3-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide
CID 133141017
2-[[2-(bromomethyl)pyrrolidin-1-yl]methyl]quinoline
CID 80675692
N-[[1-(quinolin-2-ylmethyl)triazol-4-yl]methyl]propan-2-amine
CID 66193959
N-(2-methoxyethyl)-2-[8-methyl-7-[(1-propan-2-ylpyrazol-4-yl)methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]acetamide
CID 131647888

Frequently Asked Questions

What is the IUPAC name of (8R)-8-methyl-N-propan-2-yl-7-(quinolin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?
The IUPAC name of (8R)-8-methyl-N-propan-2-yl-7-(quinolin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide (CID 124806170) is (8R)-8-methyl-N-propan-2-yl-7-(quinolin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide.
What is the SMILES notation for (8R)-8-methyl-N-propan-2-yl-7-(quinolin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?
The canonical SMILES for (8R)-8-methyl-N-propan-2-yl-7-(quinolin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide is CC(C)NC(=O)c1cn2c(n1)[C@@H](C)N(Cc1ccc3ccccc3n1)CC2.
What is the InChIKey of (8R)-8-methyl-N-propan-2-yl-7-(quinolin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?
The InChIKey is NFEDQJVCUIJYMM-OAHLLOKOSA-N. The full InChI is InChI=1S/C21H25N5O/c1-14(2)22-21(27)19-13-26-11-10-25(15(3)20(26)24-19)12-17-9-8-16-6-4-5-7-18(16)23-17/h4-9,13-15H,10-12H2,1-3H3,(H,22,27)/t15-/m1/s1.
What are the key properties of (8R)-8-methyl-N-propan-2-yl-7-(quinolin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide?
(8R)-8-methyl-N-propan-2-yl-7-(quinolin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide has a molecular weight of 363.47 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (8R)-8-methyl-N-propan-2-yl-7-(quinolin-2-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxamide is sourced from PubChem (CID 124806170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).