N-cyclopropyl-5-(1-cyclopropyl-4-propan-2-ylpyrazol-5-yl)-6-fluoropyridin-2-amine

C17H21FN4 — CID 166511085

IUPACN-cyclopropyl-5-(1-cyclopropyl-4-propan-2-ylpyrazol-5-yl)-6-fluoropyridin-2-amine
SMILESCC(C)c1cnn(C2CC2)c1-c1ccc(NC2CC2)nc1F
InChIInChI=1S/C17H21FN4/c1-10(2)14-9-19-22(12-5-6-12)16(14)13-7-8-15(21-17(13)18)20-11-3-4-11/h7-12H,3-6H2,1-2H3,(H,20,21)
InChIKeyCBCMFJVAEHFHOX-UHFFFAOYSA-N
MW300.38 g/mol
LogP4.12
Rot. Bonds5

About N-cyclopropyl-5-(1-cyclopropyl-4-propan-2-ylpyrazol-5-yl)-6-fluoropyridin-2-amine

N-cyclopropyl-5-(1-cyclopropyl-4-propan-2-ylpyrazol-5-yl)-6-fluoropyridin-2-amine (PubChem CID 166511085) has the molecular formula C17H21FN4 and a molecular weight of 300.38 g/mol. Its IUPAC name is N-cyclopropyl-5-(1-cyclopropyl-4-propan-2-ylpyrazol-5-yl)-6-fluoropyridin-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-5-(1-cyclopropyl-4-propan-2-ylpyrazol-5-yl)-6-fluoropyridin-2-amine
PubChem CID166511085
Molecular FormulaC17H21FN4
Molecular Weight300.38 g/mol
Exact Mass300.18
IUPAC NameN-cyclopropyl-5-(1-cyclopropyl-4-propan-2-ylpyrazol-5-yl)-6-fluoropyridin-2-amine
SMILESCC(C)c1cnn(C2CC2)c1-c1ccc(NC2CC2)nc1F
InChIInChI=1S/C17H21FN4/c1-10(2)14-9-19-22(12-5-6-12)16(14)13-7-8-15(21-17(13)18)20-11-3-4-11/h7-12H,3-6H2,1-2H3,(H,20,21)
InChIKeyCBCMFJVAEHFHOX-UHFFFAOYSA-N
XLogP4.12
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.38
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-cyclopropyl-6-fluoro-5-propan-2-ylpyridin-2-amine
CID 165166462
6-ethyl-2-fluoro-3-[1-(1-methylpiperidin-4-yl)-4-propan-2-ylpyrazol-5-yl]pyridine
CID 166511087
1-cyclopropyl-5-(difluoromethyl)-4-propan-2-ylpyrazole
CID 169167177
N-cyclopropyl-6-fluoro-5-[4-methylsulfanyl-1-(oxetan-3-yl)pyrazol-3-yl]pyridin-2-amine
CID 167271296
1-[5-(6-bromo-2-fluoro-3-pyridinyl)-1-(oxan-4-yl)pyrazol-4-yl]ethanone
CID 167531567
1-(4-methoxycyclohexyl)-5-methyl-4-propan-2-ylpyrazole
CID 176692261
N-cyclopropyl-4,8-di(propan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-amine
CID 156513284
N-cyclopropyl-2-propan-2-ylpyrimidin-4-amine
CID 130920544
5-[(Z)-1-amino-3-methyl-2-(2,2,2-trifluoroethyliminomethyl)but-1-enyl]-N-cyclopropyl-6-fluoropyridin-2-amine
CID 156729966
N-cyclopropyl-5-fluoropyridin-2-amine
CID 61313330
1-cyclopropyl-5-propan-2-yltriazole
CID 166500050
1-[2-[6-(cyclohexylamino)-2-fluoro-3-pyridinyl]-4-(propan-2-ylamino)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]ethanone
CID 151582931

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-(1-cyclopropyl-4-propan-2-ylpyrazol-5-yl)-6-fluoropyridin-2-amine?
The IUPAC name of N-cyclopropyl-5-(1-cyclopropyl-4-propan-2-ylpyrazol-5-yl)-6-fluoropyridin-2-amine (CID 166511085) is N-cyclopropyl-5-(1-cyclopropyl-4-propan-2-ylpyrazol-5-yl)-6-fluoropyridin-2-amine.
What is the SMILES notation for N-cyclopropyl-5-(1-cyclopropyl-4-propan-2-ylpyrazol-5-yl)-6-fluoropyridin-2-amine?
The canonical SMILES for N-cyclopropyl-5-(1-cyclopropyl-4-propan-2-ylpyrazol-5-yl)-6-fluoropyridin-2-amine is CC(C)c1cnn(C2CC2)c1-c1ccc(NC2CC2)nc1F.
What is the InChIKey of N-cyclopropyl-5-(1-cyclopropyl-4-propan-2-ylpyrazol-5-yl)-6-fluoropyridin-2-amine?
The InChIKey is CBCMFJVAEHFHOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21FN4/c1-10(2)14-9-19-22(12-5-6-12)16(14)13-7-8-15(21-17(13)18)20-11-3-4-11/h7-12H,3-6H2,1-2H3,(H,20,21).
What are the key properties of N-cyclopropyl-5-(1-cyclopropyl-4-propan-2-ylpyrazol-5-yl)-6-fluoropyridin-2-amine?
N-cyclopropyl-5-(1-cyclopropyl-4-propan-2-ylpyrazol-5-yl)-6-fluoropyridin-2-amine has a molecular weight of 300.38 g/mol, XLogP of 4.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-(1-cyclopropyl-4-propan-2-ylpyrazol-5-yl)-6-fluoropyridin-2-amine is sourced from PubChem (CID 166511085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).