N-cyclohexyl-6-imidazol-1-ylpyrazine-2-carboxamide;difluoromethane;molecular hydrogen

C15H21F2N5O — CID 166481425

IUPACN-cyclohexyl-6-imidazol-1-ylpyrazine-2-carboxamide;difluoromethane;molecular hydrogen
SMILESFCF.O=C(NC1CCCCC1)c1cncc(-n2ccnc2)n1.[H][H]
InChIInChI=1S/C14H17N5O.CH2F2.H2/c20-14(17-11-4-2-1-3-5-11)12-8-16-9-13(18-12)19-7-6-15-10-19;2-1-3;/h6-11H,1-5H2,(H,17,20);1H2;1H
InChIKeyCPEMIXZQYUOTQJ-UHFFFAOYSA-N
MW325.36 g/mol
LogP2.85
Rot. Bonds3

About N-cyclohexyl-6-imidazol-1-ylpyrazine-2-carboxamide;difluoromethane;molecular hydrogen

N-cyclohexyl-6-imidazol-1-ylpyrazine-2-carboxamide;difluoromethane;molecular hydrogen (PubChem CID 166481425) has the molecular formula C15H21F2N5O and a molecular weight of 325.36 g/mol. Its IUPAC name is N-cyclohexyl-6-imidazol-1-ylpyrazine-2-carboxamide;difluoromethane;molecular hydrogen.

Molecular Properties

Compound NameN-cyclohexyl-6-imidazol-1-ylpyrazine-2-carboxamide;difluoromethane;molecular hydrogen
PubChem CID166481425
Molecular FormulaC15H21F2N5O
Molecular Weight325.36 g/mol
Exact Mass325.17
IUPAC NameN-cyclohexyl-6-imidazol-1-ylpyrazine-2-carboxamide;difluoromethane;molecular hydrogen
SMILESFCF.O=C(NC1CCCCC1)c1cncc(-n2ccnc2)n1.[H][H]
InChIInChI=1S/C14H17N5O.CH2F2.H2/c20-14(17-11-4-2-1-3-5-11)12-8-16-9-13(18-12)19-7-6-15-10-19;2-1-3;/h6-11H,1-5H2,(H,17,20);1H2;1H
InChIKeyCPEMIXZQYUOTQJ-UHFFFAOYSA-N
XLogP2.85
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.36
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclohexyl-6-imidazol-1-ylpyridine-2-carboxamide;2-methoxyethanol;molecular hydrogen
CID 156885840
N-cyclohexyl-4-imidazol-1-ylpyrimidine-2-carboxamide;molecular hydrogen;trifluoromethanol
CID 166480997
N-cyclohexyl-4-(difluoromethyl)-6-imidazol-1-ylpyrimidine-2-carboxamide;methanol;molecular hydrogen
CID 166480957
6-imidazol-1-yl-N-propan-2-ylpyrazine-2-carboxamide
CID 166095150
N-cyclohexyl-6-(3-methylimidazol-4-yl)pyrazine-2-carboxamide;difluoromethane
CID 166481244
N-cyclohexyl-5-imidazol-1-yl-1H-pyrazolo[3,4-c]pyridine-7-carboxamide
CID 155598646
N-cyclohexyl-2-imidazol-1-yl-6-propan-2-ylpyrimidine-4-carboxamide;methanol;molecular hydrogen
CID 166480910
N-(1-cyclohexylsulfonylpiperidin-4-yl)-6-imidazol-1-yl-4-methylpyridine-2-carboxamide
CID 170610820
1-cyclohexyl-3-[2-(6-imidazol-1-yl-2-pyridinyl)ethyl]urea
CID 70887053
6-imidazol-1-yl-N-[(3R)-oxan-3-yl]-4-(trifluoromethyl)pyridine-2-carboxamide
CID 170610880
6-imidazol-1-yl-4-methyl-N-[(3S)-piperidin-3-yl]pyridine-2-carboxamide;dihydrochloride
CID 170610902
6-[(6-imidazol-1-ylpyrazine-2-carbonyl)amino]-5-(trifluoromethyl)pyridine-3-carboxylic acid
CID 167905668

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-6-imidazol-1-ylpyrazine-2-carboxamide;difluoromethane;molecular hydrogen?
The IUPAC name of N-cyclohexyl-6-imidazol-1-ylpyrazine-2-carboxamide;difluoromethane;molecular hydrogen (CID 166481425) is N-cyclohexyl-6-imidazol-1-ylpyrazine-2-carboxamide;difluoromethane;molecular hydrogen.
What is the SMILES notation for N-cyclohexyl-6-imidazol-1-ylpyrazine-2-carboxamide;difluoromethane;molecular hydrogen?
The canonical SMILES for N-cyclohexyl-6-imidazol-1-ylpyrazine-2-carboxamide;difluoromethane;molecular hydrogen is FCF.O=C(NC1CCCCC1)c1cncc(-n2ccnc2)n1.[H][H].
What is the InChIKey of N-cyclohexyl-6-imidazol-1-ylpyrazine-2-carboxamide;difluoromethane;molecular hydrogen?
The InChIKey is CPEMIXZQYUOTQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O.CH2F2.H2/c20-14(17-11-4-2-1-3-5-11)12-8-16-9-13(18-12)19-7-6-15-10-19;2-1-3;/h6-11H,1-5H2,(H,17,20);1H2;1H.
What are the key properties of N-cyclohexyl-6-imidazol-1-ylpyrazine-2-carboxamide;difluoromethane;molecular hydrogen?
N-cyclohexyl-6-imidazol-1-ylpyrazine-2-carboxamide;difluoromethane;molecular hydrogen has a molecular weight of 325.36 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-6-imidazol-1-ylpyrazine-2-carboxamide;difluoromethane;molecular hydrogen is sourced from PubChem (CID 166481425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).