N-[[6-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine

C15H22N4 — CID 62491762

IUPACN-[[6-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine
SMILESCC(C)NCc1ccc(-n2ccc(C(C)C)n2)nc1
InChIInChI=1S/C15H22N4/c1-11(2)14-7-8-19(18-14)15-6-5-13(10-17-15)9-16-12(3)4/h5-8,10-12,16H,9H2,1-4H3
InChIKeyIXHZPLDSTOFFTG-UHFFFAOYSA-N
MW258.37 g/mol
LogP2.89
Rot. Bonds5

About N-[[6-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine

N-[[6-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine (PubChem CID 62491762) has the molecular formula C15H22N4 and a molecular weight of 258.37 g/mol. Its IUPAC name is N-[[6-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[6-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine
PubChem CID62491762
Molecular FormulaC15H22N4
Molecular Weight258.37 g/mol
Exact Mass258.18
IUPAC NameN-[[6-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine
SMILESCC(C)NCc1ccc(-n2ccc(C(C)C)n2)nc1
InChIInChI=1S/C15H22N4/c1-11(2)14-7-8-19(18-14)15-6-5-13(10-17-15)9-16-12(3)4/h5-8,10-12,16H,9H2,1-4H3
InChIKeyIXHZPLDSTOFFTG-UHFFFAOYSA-N
XLogP2.89
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[6-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine with MolForge

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Related Compounds

N-[[5-chloro-6-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine
CID 62490052
N-[[6-(3-propan-2-ylpyrazol-1-yl)pyridazin-3-yl]methyl]propan-2-amine
CID 62492116
N-[[6-(4-methylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine
CID 62294736
N-[[3,5-difluoro-4-(3-propan-2-ylpyrazol-1-yl)phenyl]methyl]propan-2-amine
CID 63078057
N-[[2-(3-propan-2-ylpyrazol-1-yl)phenyl]methyl]propan-2-amine
CID 62487799
N-[(6-thiomorpholin-4-yl-3-pyridinyl)methyl]propan-2-amine
CID 62280369
1-[5-[(propan-2-ylamino)methyl]-2-pyridinyl]azetidin-3-amine
CID 165486620
N-[[3-fluoro-2-(3-propan-2-ylpyrazol-1-yl)-4-pyridinyl]methyl]propan-2-amine
CID 105390657
N-[[6-(3-methylpiperidin-1-yl)-3-pyridinyl]methyl]propan-2-amine
CID 55055089
N-[[6-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]propan-2-amine
CID 55054509
N-[[5-(3-propan-2-ylpyrazol-1-yl)pyrazin-2-yl]methyl]cyclopropanamine
CID 107381217
N-methyl-1-[6-(3-propan-2-ylpyrazol-1-yl)pyridazin-3-yl]methanamine
CID 62491947

Frequently Asked Questions

What is the IUPAC name of N-[[6-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine?
The IUPAC name of N-[[6-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine (CID 62491762) is N-[[6-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine.
What is the SMILES notation for N-[[6-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine?
The canonical SMILES for N-[[6-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine is CC(C)NCc1ccc(-n2ccc(C(C)C)n2)nc1.
What is the InChIKey of N-[[6-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine?
The InChIKey is IXHZPLDSTOFFTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4/c1-11(2)14-7-8-19(18-14)15-6-5-13(10-17-15)9-16-12(3)4/h5-8,10-12,16H,9H2,1-4H3.
What are the key properties of N-[[6-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine?
N-[[6-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine has a molecular weight of 258.37 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methyl]propan-2-amine is sourced from PubChem (CID 62491762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).