1-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-4-amine

C15H20N4 — CID 43745344

IUPAC1-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-4-amine
SMILESCN1CCC(Nc2cccc(-c3ccn[nH]3)c2)CC1
InChIInChI=1S/C15H20N4/c1-19-9-6-13(7-10-19)17-14-4-2-3-12(11-14)15-5-8-16-18-15/h2-5,8,11,13,17H,6-7,9-10H2,1H3,(H,16,18)
InChIKeyIAJOXETUYRFZOK-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.58
Rot. Bonds3

About 1-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-4-amine

1-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-4-amine (PubChem CID 43745344) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 1-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-4-amine.

Molecular Properties

Compound Name1-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-4-amine
PubChem CID43745344
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name1-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-4-amine
SMILESCN1CCC(Nc2cccc(-c3ccn[nH]3)c2)CC1
InChIInChI=1S/C15H20N4/c1-19-9-6-13(7-10-19)17-14-4-2-3-12(11-14)15-5-8-16-18-15/h2-5,8,11,13,17H,6-7,9-10H2,1H3,(H,16,18)
InChIKeyIAJOXETUYRFZOK-UHFFFAOYSA-N
XLogP2.58
TPSA43.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]azepan-4-amine
CID 65070382
N-[3-(1H-pyrazol-5-yl)phenyl]cycloheptanamine
CID 43745342
1-prop-2-ynyl-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-4-amine
CID 43790946
N-[3-(1H-pyrazol-5-yl)phenyl]pyrrolidin-3-amine
CID 79730682
1,5-dimethyl-N-[3-(1H-pyrazol-5-yl)phenyl]pyrrolidin-3-amine
CID 81466627
N-(3,3-dimethylcyclopentyl)-3-(1H-pyrazol-5-yl)aniline
CID 80705471
N-(2,3-dimethylcyclohexyl)-3-(1H-pyrazol-5-yl)aniline
CID 64762657
N-(2,2-dimethylcyclohexyl)-3-(1H-pyrazol-5-yl)aniline
CID 79834530
1-methyl-N-[3-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]pyrrolidin-3-amine
CID 55141406
N-(3-chlorophenyl)-1-methylpiperidin-4-amine
CID 13336311
1-methyl-N-[3-(2H-tetrazol-5-yl)phenyl]azepan-4-amine
CID 65070524
N-tert-butyl-3-(1H-pyrazol-5-yl)aniline
CID 58709859

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-4-amine?
The IUPAC name of 1-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-4-amine (CID 43745344) is 1-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-4-amine.
What is the SMILES notation for 1-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-4-amine?
The canonical SMILES for 1-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-4-amine is CN1CCC(Nc2cccc(-c3ccn[nH]3)c2)CC1.
What is the InChIKey of 1-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-4-amine?
The InChIKey is IAJOXETUYRFZOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-19-9-6-13(7-10-19)17-14-4-2-3-12(11-14)15-5-8-16-18-15/h2-5,8,11,13,17H,6-7,9-10H2,1H3,(H,16,18).
What are the key properties of 1-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-4-amine?
1-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-4-amine has a molecular weight of 256.35 g/mol, XLogP of 2.58, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-4-amine is sourced from PubChem (CID 43745344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).