1-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]piperidin-3-amine

C15H20N4O — CID 56771509

IUPAC1-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]piperidin-3-amine
SMILESCOc1cccc(-c2cc(N3CCCC(N)C3)n[nH]2)c1
InChIInChI=1S/C15H20N4O/c1-20-13-6-2-4-11(8-13)14-9-15(18-17-14)19-7-3-5-12(16)10-19/h2,4,6,8-9,12H,3,5,7,10,16H2,1H3,(H,17,18)
InChIKeyZIIDJLZIZIQMOB-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.01
Rot. Bonds3

About 1-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]piperidin-3-amine

1-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]piperidin-3-amine (PubChem CID 56771509) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 1-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]piperidin-3-amine.

Molecular Properties

Compound Name1-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]piperidin-3-amine
PubChem CID56771509
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name1-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]piperidin-3-amine
SMILESCOc1cccc(-c2cc(N3CCCC(N)C3)n[nH]2)c1
InChIInChI=1S/C15H20N4O/c1-20-13-6-2-4-11(8-13)14-9-15(18-17-14)19-7-3-5-12(16)10-19/h2,4,6,8-9,12H,3,5,7,10,16H2,1H3,(H,17,18)
InChIKeyZIIDJLZIZIQMOB-UHFFFAOYSA-N
XLogP2.01
TPSA67.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(5-phenyl-1H-pyrazol-3-yl)pyrrolidin-3-amine
CID 56771527
1-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]piperidine-4-carboxylic acid
CID 56771437
1-[5-(3-bromo-4-fluorophenyl)-1H-pyrazol-3-yl]piperidin-3-amine
CID 114697836
1-(3-methoxyphenyl)piperidin-3-amine;dihydrochloride
CID 168974066
1-[5-(1,3-benzodioxol-5-yl)-1H-pyrazol-3-yl]piperidin-3-amine
CID 56771507
1-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]piperidine-3-carboxylic acid
CID 56771463
1-[5-(1-benzofuran-2-yl)-1H-pyrazol-3-yl]piperidin-3-amine
CID 114697842
1-[5-(4-ethylphenyl)-1H-pyrazol-3-yl]pyrrolidin-3-amine
CID 56771532
1-[5-(2-chloro-4-fluorophenyl)-1H-pyrazol-3-yl]piperidin-3-amine
CID 114697799
1-[6-[3-(1H-pyrazol-4-yl)phenoxy]pyridazin-3-yl]piperidin-3-amine
CID 162705859
(3-methoxyphenyl)-[4-(5-phenyl-1H-pyrazol-3-yl)-1,4-diazepan-1-yl]methanone
CID 53180949
3-methoxy-N-[1-(5-phenyl-1H-pyrazol-3-yl)piperidin-4-yl]benzamide
CID 75528481

Frequently Asked Questions

What is the IUPAC name of 1-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]piperidin-3-amine?
The IUPAC name of 1-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]piperidin-3-amine (CID 56771509) is 1-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]piperidin-3-amine.
What is the SMILES notation for 1-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]piperidin-3-amine?
The canonical SMILES for 1-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]piperidin-3-amine is COc1cccc(-c2cc(N3CCCC(N)C3)n[nH]2)c1.
What is the InChIKey of 1-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]piperidin-3-amine?
The InChIKey is ZIIDJLZIZIQMOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-20-13-6-2-4-11(8-13)14-9-15(18-17-14)19-7-3-5-12(16)10-19/h2,4,6,8-9,12H,3,5,7,10,16H2,1H3,(H,17,18).
What are the key properties of 1-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]piperidin-3-amine?
1-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]piperidin-3-amine has a molecular weight of 272.35 g/mol, XLogP of 2.01, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]piperidin-3-amine is sourced from PubChem (CID 56771509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).