1-(1-methylpiperidin-3-yl)-N-[(2-pyrazol-1-ylphenyl)methyl]methanamine

C17H24N4 — CID 62658500

IUPAC1-(1-methylpiperidin-3-yl)-N-[(2-pyrazol-1-ylphenyl)methyl]methanamine
SMILESCN1CCCC(CNCc2ccccc2-n2cccn2)C1
InChIInChI=1S/C17H24N4/c1-20-10-4-6-15(14-20)12-18-13-16-7-2-3-8-17(16)21-11-5-9-19-21/h2-3,5,7-9,11,15,18H,4,6,10,12-14H2,1H3
InChIKeySXPKPICZMNGZHH-UHFFFAOYSA-N
MW284.41 g/mol
LogP2.30
Rot. Bonds5

About 1-(1-methylpiperidin-3-yl)-N-[(2-pyrazol-1-ylphenyl)methyl]methanamine

1-(1-methylpiperidin-3-yl)-N-[(2-pyrazol-1-ylphenyl)methyl]methanamine (PubChem CID 62658500) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is 1-(1-methylpiperidin-3-yl)-N-[(2-pyrazol-1-ylphenyl)methyl]methanamine.

Molecular Properties

Compound Name1-(1-methylpiperidin-3-yl)-N-[(2-pyrazol-1-ylphenyl)methyl]methanamine
PubChem CID62658500
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC Name1-(1-methylpiperidin-3-yl)-N-[(2-pyrazol-1-ylphenyl)methyl]methanamine
SMILESCN1CCCC(CNCc2ccccc2-n2cccn2)C1
InChIInChI=1S/C17H24N4/c1-20-10-4-6-15(14-20)12-18-13-16-7-2-3-8-17(16)21-11-5-9-19-21/h2-3,5,7-9,11,15,18H,4,6,10,12-14H2,1H3
InChIKeySXPKPICZMNGZHH-UHFFFAOYSA-N
XLogP2.30
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-N-[(2-pyrazol-1-ylphenyl)methyl]azepan-4-amine
CID 65070198
5-[[(2-pyrazol-1-ylphenyl)methylamino]methyl]pyrrolidin-2-one
CID 103743104
N-[(5-bromoquinolin-8-yl)methyl]-1-(1-methylpiperidin-3-yl)methanamine
CID 115959253
1-(3,4-dihydro-2H-pyran-2-yl)-N-[(2-pyrazol-1-ylphenyl)methyl]methanamine
CID 62064595
N-[(2-pyrazol-1-ylphenyl)methyl]cyclooctanamine
CID 61168084
1-(1-methylpiperidin-3-yl)-N-[[2-(pyridin-3-ylmethoxy)phenyl]methyl]methanamine
CID 119125973
6-[(dimethylamino)methyl]-N-[(2-pyrazol-1-ylphenyl)methyl]-1,4-oxazepane-4-carboxamide
CID 121499248
1-(1-methylpiperidin-3-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)methanamine
CID 62653976
1-N-[(2-pyrazol-1-ylphenyl)methyl]piperidine-1,4-dicarboxamide
CID 56820950
4-N-[(2-pyrazol-1-ylphenyl)methyl]cyclohexane-1,4-diamine
CID 79742029
methyl 2-[(2-pyrazol-1-ylphenyl)methylamino]acetate
CID 61167303
N-[(2-fluorophenyl)methyl]-1-(2-pyrazol-1-ylphenyl)methanamine
CID 61167301

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylpiperidin-3-yl)-N-[(2-pyrazol-1-ylphenyl)methyl]methanamine?
The IUPAC name of 1-(1-methylpiperidin-3-yl)-N-[(2-pyrazol-1-ylphenyl)methyl]methanamine (CID 62658500) is 1-(1-methylpiperidin-3-yl)-N-[(2-pyrazol-1-ylphenyl)methyl]methanamine.
What is the SMILES notation for 1-(1-methylpiperidin-3-yl)-N-[(2-pyrazol-1-ylphenyl)methyl]methanamine?
The canonical SMILES for 1-(1-methylpiperidin-3-yl)-N-[(2-pyrazol-1-ylphenyl)methyl]methanamine is CN1CCCC(CNCc2ccccc2-n2cccn2)C1.
What is the InChIKey of 1-(1-methylpiperidin-3-yl)-N-[(2-pyrazol-1-ylphenyl)methyl]methanamine?
The InChIKey is SXPKPICZMNGZHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4/c1-20-10-4-6-15(14-20)12-18-13-16-7-2-3-8-17(16)21-11-5-9-19-21/h2-3,5,7-9,11,15,18H,4,6,10,12-14H2,1H3.
What are the key properties of 1-(1-methylpiperidin-3-yl)-N-[(2-pyrazol-1-ylphenyl)methyl]methanamine?
1-(1-methylpiperidin-3-yl)-N-[(2-pyrazol-1-ylphenyl)methyl]methanamine has a molecular weight of 284.41 g/mol, XLogP of 2.30, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylpiperidin-3-yl)-N-[(2-pyrazol-1-ylphenyl)methyl]methanamine is sourced from PubChem (CID 62658500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).