5-amino-1-cyclohexyl-3-morpholin-4-ylpyrazole-4-carbonitrile

C14H21N5O — CID 102808763

IUPAC5-amino-1-cyclohexyl-3-morpholin-4-ylpyrazole-4-carbonitrile
SMILESN#Cc1c(N2CCOCC2)nn(C2CCCCC2)c1N
InChIInChI=1S/C14H21N5O/c15-10-12-13(16)19(11-4-2-1-3-5-11)17-14(12)18-6-8-20-9-7-18/h11H,1-9,16H2
InChIKeyHFHFPZKKKSEAAA-UHFFFAOYSA-N
MW275.36 g/mol
LogP1.68
Rot. Bonds2

About 5-amino-1-cyclohexyl-3-morpholin-4-ylpyrazole-4-carbonitrile

5-amino-1-cyclohexyl-3-morpholin-4-ylpyrazole-4-carbonitrile (PubChem CID 102808763) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is 5-amino-1-cyclohexyl-3-morpholin-4-ylpyrazole-4-carbonitrile.

Molecular Properties

Compound Name5-amino-1-cyclohexyl-3-morpholin-4-ylpyrazole-4-carbonitrile
PubChem CID102808763
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC Name5-amino-1-cyclohexyl-3-morpholin-4-ylpyrazole-4-carbonitrile
SMILESN#Cc1c(N2CCOCC2)nn(C2CCCCC2)c1N
InChIInChI=1S/C14H21N5O/c15-10-12-13(16)19(11-4-2-1-3-5-11)17-14(12)18-6-8-20-9-7-18/h11H,1-9,16H2
InChIKeyHFHFPZKKKSEAAA-UHFFFAOYSA-N
XLogP1.68
TPSA80.10 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-amino-1-cyclohexyl-3-[2-(hydroxymethyl)pyrrolidin-1-yl]pyrazole-4-carbonitrile
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CID 102796104
5-amino-1-cycloheptyl-3-(diethylamino)pyrazole-4-carbonitrile
CID 102796097
7-cyclohexyl-1,3-dimorpholin-4-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile
CID 3771706
5-amino-3-morpholin-4-yl-1-pyrimidin-4-ylpyrazole-4-carbonitrile
CID 102809182
5-amino-3-morpholin-4-yl-1-(1,3-thiazol-2-yl)pyrazole-4-carbonitrile
CID 102809221
3-chloro-7-cyclohexyl-1-morpholin-4-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile
CID 3249876
5-amino-1-cyclopentyl-3-(cyclopropylmethylamino)pyrazole-4-carbonitrile
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5-amino-1-tert-butyl-3-pyrrolidin-1-ylpyrazole-4-carbonitrile
CID 102795651
5-amino-4-(cyclopentylamino)-6-morpholin-4-ylpyrimidine-2-carbonitrile
CID 44565778
2-cycloheptyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carbonitrile
CID 105489761
2-cyclohexyl-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-3-amine
CID 105478038

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-cyclohexyl-3-morpholin-4-ylpyrazole-4-carbonitrile?
The IUPAC name of 5-amino-1-cyclohexyl-3-morpholin-4-ylpyrazole-4-carbonitrile (CID 102808763) is 5-amino-1-cyclohexyl-3-morpholin-4-ylpyrazole-4-carbonitrile.
What is the SMILES notation for 5-amino-1-cyclohexyl-3-morpholin-4-ylpyrazole-4-carbonitrile?
The canonical SMILES for 5-amino-1-cyclohexyl-3-morpholin-4-ylpyrazole-4-carbonitrile is N#Cc1c(N2CCOCC2)nn(C2CCCCC2)c1N.
What is the InChIKey of 5-amino-1-cyclohexyl-3-morpholin-4-ylpyrazole-4-carbonitrile?
The InChIKey is HFHFPZKKKSEAAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c15-10-12-13(16)19(11-4-2-1-3-5-11)17-14(12)18-6-8-20-9-7-18/h11H,1-9,16H2.
What are the key properties of 5-amino-1-cyclohexyl-3-morpholin-4-ylpyrazole-4-carbonitrile?
5-amino-1-cyclohexyl-3-morpholin-4-ylpyrazole-4-carbonitrile has a molecular weight of 275.36 g/mol, XLogP of 1.68, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-cyclohexyl-3-morpholin-4-ylpyrazole-4-carbonitrile is sourced from PubChem (CID 102808763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).