[5-chloro-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-pyridinyl]methanamine

C10H11ClN4O — CID 81342055

IUPAC[5-chloro-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-pyridinyl]methanamine
SMILESCc1cc(Oc2ncc(CN)cc2Cl)n[nH]1
InChIInChI=1S/C10H11ClN4O/c1-6-2-9(15-14-6)16-10-8(11)3-7(4-12)5-13-10/h2-3,5H,4,12H2,1H3,(H,14,15)
InChIKeySLJYPMUPHDGMDS-UHFFFAOYSA-N
MW238.68 g/mol
LogP2.02
Rot. Bonds3

About [5-chloro-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-pyridinyl]methanamine

[5-chloro-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-pyridinyl]methanamine (PubChem CID 81342055) has the molecular formula C10H11ClN4O and a molecular weight of 238.68 g/mol. Its IUPAC name is [5-chloro-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[5-chloro-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-pyridinyl]methanamine
PubChem CID81342055
Molecular FormulaC10H11ClN4O
Molecular Weight238.68 g/mol
Exact Mass238.06
IUPAC Name[5-chloro-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-pyridinyl]methanamine
SMILESCc1cc(Oc2ncc(CN)cc2Cl)n[nH]1
InChIInChI=1S/C10H11ClN4O/c1-6-2-9(15-14-6)16-10-8(11)3-7(4-12)5-13-10/h2-3,5H,4,12H2,1H3,(H,14,15)
InChIKeySLJYPMUPHDGMDS-UHFFFAOYSA-N
XLogP2.02
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.68
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[5-chloro-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-pyridinyl]methyl]ethanamine
CID 81342700
5-chloro-6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyridine-3-carboxylic acid
CID 81341368
5-(fluoromethyl)-3-methyl-2-[(5-methyl-1H-pyrazol-3-yl)oxy]pyridine
CID 70898670
[4-[(5-methyl-1H-pyrazol-3-yl)oxy]phenyl]methanamine
CID 81342015
[3-[(5-methyl-1H-pyrazol-3-yl)oxy]phenyl]methanamine
CID 102814719
[5-chloro-6-(2,5-dichlorophenoxy)-3-pyridinyl]methanamine
CID 62296562
5-bromo-2-[(5-methyl-1H-pyrazol-3-yl)oxy]pyridin-3-amine
CID 81341926
5-chloro-4-(chloromethyl)-2-[(5-methyl-1H-pyrazol-3-yl)oxy]pyridine
CID 114921335
[5-chloro-6-(3-chlorophenoxy)-3-pyridinyl]methanamine
CID 62321461
[6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazin-2-yl]methanamine
CID 81342057
[5-chloro-2-[(5-methyl-1H-pyrazol-3-yl)oxy]-4-pyridinyl]methanol
CID 114920744
(6-methoxy-5-methyl-3-pyridinyl)methanamine
CID 59238572

Frequently Asked Questions

What is the IUPAC name of [5-chloro-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-pyridinyl]methanamine?
The IUPAC name of [5-chloro-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-pyridinyl]methanamine (CID 81342055) is [5-chloro-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-pyridinyl]methanamine.
What is the SMILES notation for [5-chloro-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-pyridinyl]methanamine?
The canonical SMILES for [5-chloro-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-pyridinyl]methanamine is Cc1cc(Oc2ncc(CN)cc2Cl)n[nH]1.
What is the InChIKey of [5-chloro-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-pyridinyl]methanamine?
The InChIKey is SLJYPMUPHDGMDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN4O/c1-6-2-9(15-14-6)16-10-8(11)3-7(4-12)5-13-10/h2-3,5H,4,12H2,1H3,(H,14,15).
What are the key properties of [5-chloro-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-pyridinyl]methanamine?
[5-chloro-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-pyridinyl]methanamine has a molecular weight of 238.68 g/mol, XLogP of 2.02, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-chloro-6-[(5-methyl-1H-pyrazol-3-yl)oxy]-3-pyridinyl]methanamine is sourced from PubChem (CID 81342055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).