(1,5-dimethylpyrazol-3-yl)-(3-methoxy-2-pyridinyl)methanamine

C12H16N4O — CID 114220495

IUPAC(1,5-dimethylpyrazol-3-yl)-(3-methoxy-2-pyridinyl)methanamine
SMILESCOc1cccnc1C(N)c1cc(C)n(C)n1
InChIInChI=1S/C12H16N4O/c1-8-7-9(15-16(8)2)11(13)12-10(17-3)5-4-6-14-12/h4-7,11H,13H2,1-3H3
InChIKeyZZWYXVARQRZZPX-UHFFFAOYSA-N
MW232.29 g/mol
LogP1.18
Rot. Bonds3

About (1,5-dimethylpyrazol-3-yl)-(3-methoxy-2-pyridinyl)methanamine

(1,5-dimethylpyrazol-3-yl)-(3-methoxy-2-pyridinyl)methanamine (PubChem CID 114220495) has the molecular formula C12H16N4O and a molecular weight of 232.29 g/mol. Its IUPAC name is (1,5-dimethylpyrazol-3-yl)-(3-methoxy-2-pyridinyl)methanamine.

Molecular Properties

Compound Name(1,5-dimethylpyrazol-3-yl)-(3-methoxy-2-pyridinyl)methanamine
PubChem CID114220495
Molecular FormulaC12H16N4O
Molecular Weight232.29 g/mol
Exact Mass232.13
IUPAC Name(1,5-dimethylpyrazol-3-yl)-(3-methoxy-2-pyridinyl)methanamine
SMILESCOc1cccnc1C(N)c1cc(C)n(C)n1
InChIInChI=1S/C12H16N4O/c1-8-7-9(15-16(8)2)11(13)12-10(17-3)5-4-6-14-12/h4-7,11H,13H2,1-3H3
InChIKeyZZWYXVARQRZZPX-UHFFFAOYSA-N
XLogP1.18
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2,5-dimethylphenyl)-(3-methoxy-2-pyridinyl)methanamine
CID 114054595
(3-bromo-4-methylphenyl)-(3-methoxy-2-pyridinyl)methanamine
CID 114054024
(4-methoxy-1-methylpyrazol-5-yl)-(3-methyl-2-pyridinyl)methanamine
CID 114648978
(4-bromophenyl)-(3-methoxy-2-pyridinyl)methanamine
CID 114053803
1-benzofuran-2-yl-(1,5-dimethylpyrazol-3-yl)methanamine
CID 114219353
(1S)-1-(3-methoxy-2-pyridinyl)-2-methylpropan-1-amine
CID 130691803
(5-methoxy-1-methylpyrazol-3-yl)-(2-methoxyphenyl)methanamine
CID 114255329
(3-chloro-2-pyridinyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine
CID 103443925
(2R)-2-amino-2-(3-methoxy-2-pyridinyl)ethanol
CID 96850177
1-(3-methoxy-2-pyridinyl)pentan-1-amine
CID 55296724
2-(dichloromethyl)-3-methoxypyridine
CID 141354456
2-amino-2-(3-methoxy-2-pyridinyl)acetic acid
CID 55295273

Frequently Asked Questions

What is the IUPAC name of (1,5-dimethylpyrazol-3-yl)-(3-methoxy-2-pyridinyl)methanamine?
The IUPAC name of (1,5-dimethylpyrazol-3-yl)-(3-methoxy-2-pyridinyl)methanamine (CID 114220495) is (1,5-dimethylpyrazol-3-yl)-(3-methoxy-2-pyridinyl)methanamine.
What is the SMILES notation for (1,5-dimethylpyrazol-3-yl)-(3-methoxy-2-pyridinyl)methanamine?
The canonical SMILES for (1,5-dimethylpyrazol-3-yl)-(3-methoxy-2-pyridinyl)methanamine is COc1cccnc1C(N)c1cc(C)n(C)n1.
What is the InChIKey of (1,5-dimethylpyrazol-3-yl)-(3-methoxy-2-pyridinyl)methanamine?
The InChIKey is ZZWYXVARQRZZPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O/c1-8-7-9(15-16(8)2)11(13)12-10(17-3)5-4-6-14-12/h4-7,11H,13H2,1-3H3.
What are the key properties of (1,5-dimethylpyrazol-3-yl)-(3-methoxy-2-pyridinyl)methanamine?
(1,5-dimethylpyrazol-3-yl)-(3-methoxy-2-pyridinyl)methanamine has a molecular weight of 232.29 g/mol, XLogP of 1.18, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1,5-dimethylpyrazol-3-yl)-(3-methoxy-2-pyridinyl)methanamine is sourced from PubChem (CID 114220495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).