[3-chloro-2-(1-propylpyrazol-4-yl)oxy-4-pyridinyl]methanamine

C12H15ClN4O — CID 107056208

IUPAC[3-chloro-2-(1-propylpyrazol-4-yl)oxy-4-pyridinyl]methanamine
SMILESCCCn1cc(Oc2nccc(CN)c2Cl)cn1
InChIInChI=1S/C12H15ClN4O/c1-2-5-17-8-10(7-16-17)18-12-11(13)9(6-14)3-4-15-12/h3-4,7-8H,2,5-6,14H2,1H3
InChIKeyWIJFEWGSCGZXPZ-UHFFFAOYSA-N
MW266.73 g/mol
LogP2.59
Rot. Bonds5

About [3-chloro-2-(1-propylpyrazol-4-yl)oxy-4-pyridinyl]methanamine

[3-chloro-2-(1-propylpyrazol-4-yl)oxy-4-pyridinyl]methanamine (PubChem CID 107056208) has the molecular formula C12H15ClN4O and a molecular weight of 266.73 g/mol. Its IUPAC name is [3-chloro-2-(1-propylpyrazol-4-yl)oxy-4-pyridinyl]methanamine.

Molecular Properties

Compound Name[3-chloro-2-(1-propylpyrazol-4-yl)oxy-4-pyridinyl]methanamine
PubChem CID107056208
Molecular FormulaC12H15ClN4O
Molecular Weight266.73 g/mol
Exact Mass266.09
IUPAC Name[3-chloro-2-(1-propylpyrazol-4-yl)oxy-4-pyridinyl]methanamine
SMILESCCCn1cc(Oc2nccc(CN)c2Cl)cn1
InChIInChI=1S/C12H15ClN4O/c1-2-5-17-8-10(7-16-17)18-12-11(13)9(6-14)3-4-15-12/h3-4,7-8H,2,5-6,14H2,1H3
InChIKeyWIJFEWGSCGZXPZ-UHFFFAOYSA-N
XLogP2.59
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.73
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [3-chloro-2-(1-propylpyrazol-4-yl)oxy-4-pyridinyl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-methyl-2-(1-propylpyrazol-4-yl)oxypyridin-3-amine
CID 116800363
[1-(1-propylpyrazol-4-yl)oxyisoquinolin-4-yl]methanamine
CID 106777567
[5-(1-propylpyrazol-4-yl)oxypyrazin-2-yl]methanamine
CID 116800165
[3-chloro-2-(4-ethoxyphenoxy)-4-pyridinyl]methanamine
CID 107055931
2-(1-propylpyrazol-4-yl)oxypyridin-4-amine
CID 116800439
[2-bromo-4-(1-propylpyrazol-4-yl)oxyphenyl]methanamine
CID 107275288
2-(1-propylpyrazol-4-yl)oxypyridine-3-sulfonamide
CID 116800430
(3-chloro-2-propoxy-4-pyridinyl)methanamine
CID 107056050
[3-chloro-2-(4-propan-2-ylphenoxy)-4-pyridinyl]methanamine
CID 107055933
[3-chloro-2-(3,4-dimethylphenoxy)-4-pyridinyl]methanamine
CID 107055950
[2-(4-bromo-3,5-dimethylphenoxy)-3-chloro-4-pyridinyl]methanamine
CID 107722438
[5,6-diethyl-3-(1-propylpyrazol-4-yl)oxypyridazin-4-yl]methanamine
CID 116800159

Frequently Asked Questions

What is the IUPAC name of [3-chloro-2-(1-propylpyrazol-4-yl)oxy-4-pyridinyl]methanamine?
The IUPAC name of [3-chloro-2-(1-propylpyrazol-4-yl)oxy-4-pyridinyl]methanamine (CID 107056208) is [3-chloro-2-(1-propylpyrazol-4-yl)oxy-4-pyridinyl]methanamine.
What is the SMILES notation for [3-chloro-2-(1-propylpyrazol-4-yl)oxy-4-pyridinyl]methanamine?
The canonical SMILES for [3-chloro-2-(1-propylpyrazol-4-yl)oxy-4-pyridinyl]methanamine is CCCn1cc(Oc2nccc(CN)c2Cl)cn1.
What is the InChIKey of [3-chloro-2-(1-propylpyrazol-4-yl)oxy-4-pyridinyl]methanamine?
The InChIKey is WIJFEWGSCGZXPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClN4O/c1-2-5-17-8-10(7-16-17)18-12-11(13)9(6-14)3-4-15-12/h3-4,7-8H,2,5-6,14H2,1H3.
What are the key properties of [3-chloro-2-(1-propylpyrazol-4-yl)oxy-4-pyridinyl]methanamine?
[3-chloro-2-(1-propylpyrazol-4-yl)oxy-4-pyridinyl]methanamine has a molecular weight of 266.73 g/mol, XLogP of 2.59, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-chloro-2-(1-propylpyrazol-4-yl)oxy-4-pyridinyl]methanamine is sourced from PubChem (CID 107056208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).