1-(1-methylpyrazol-4-yl)-1-(2-propylpiperidin-1-yl)propan-2-amine

C15H28N4 — CID 83052284

IUPAC1-(1-methylpyrazol-4-yl)-1-(2-propylpiperidin-1-yl)propan-2-amine
SMILESCCCC1CCCCN1C(c1cnn(C)c1)C(C)N
InChIInChI=1S/C15H28N4/c1-4-7-14-8-5-6-9-19(14)15(12(2)16)13-10-17-18(3)11-13/h10-12,14-15H,4-9,16H2,1-3H3
InChIKeyHOZWZUOKTBNFNS-UHFFFAOYSA-N
MW264.42 g/mol
LogP2.46
Rot. Bonds5

About 1-(1-methylpyrazol-4-yl)-1-(2-propylpiperidin-1-yl)propan-2-amine

1-(1-methylpyrazol-4-yl)-1-(2-propylpiperidin-1-yl)propan-2-amine (PubChem CID 83052284) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is 1-(1-methylpyrazol-4-yl)-1-(2-propylpiperidin-1-yl)propan-2-amine.

Molecular Properties

Compound Name1-(1-methylpyrazol-4-yl)-1-(2-propylpiperidin-1-yl)propan-2-amine
PubChem CID83052284
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC Name1-(1-methylpyrazol-4-yl)-1-(2-propylpiperidin-1-yl)propan-2-amine
SMILESCCCC1CCCCN1C(c1cnn(C)c1)C(C)N
InChIInChI=1S/C15H28N4/c1-4-7-14-8-5-6-9-19(14)15(12(2)16)13-10-17-18(3)11-13/h10-12,14-15H,4-9,16H2,1-3H3
InChIKeyHOZWZUOKTBNFNS-UHFFFAOYSA-N
XLogP2.46
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-fluorophenyl)-1-(2-propylpiperidin-1-yl)propan-2-amine
CID 83053529
1-(3-methylphenyl)-1-(2-propylpiperidin-1-yl)propan-2-amine
CID 83053735
1-(5-methylfuran-2-yl)-1-(2-propylpiperidin-1-yl)propan-2-amine
CID 83053523
2-(2-propylpiperidin-1-yl)-2-(1-propylpyrazol-4-yl)ethanamine
CID 103571978
1-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-1-(1-methylpyrazol-4-yl)butan-2-amine
CID 102725549
1-[(1R)-1-phenylethyl]-2-propylpiperidine
CID 118395761
1-(4-fluorophenyl)-2-(2-propylpiperidin-1-yl)propan-1-amine
CID 107521942
1-(3-methylphenyl)-1-(2-propylpiperidin-1-yl)butan-2-amine
CID 83053219
1-(5-methylfuran-2-yl)-1-(2-propylpiperidin-1-yl)butan-2-amine
CID 83053424
2-(2-propylpiperidin-1-yl)pentan-3-amine
CID 83053461
1-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-1-(1-methylpyrazol-4-yl)propan-2-amine
CID 79175205
1-phenyl-2-(2-propylpiperidin-1-yl)propan-1-ol
CID 83062205

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylpyrazol-4-yl)-1-(2-propylpiperidin-1-yl)propan-2-amine?
The IUPAC name of 1-(1-methylpyrazol-4-yl)-1-(2-propylpiperidin-1-yl)propan-2-amine (CID 83052284) is 1-(1-methylpyrazol-4-yl)-1-(2-propylpiperidin-1-yl)propan-2-amine.
What is the SMILES notation for 1-(1-methylpyrazol-4-yl)-1-(2-propylpiperidin-1-yl)propan-2-amine?
The canonical SMILES for 1-(1-methylpyrazol-4-yl)-1-(2-propylpiperidin-1-yl)propan-2-amine is CCCC1CCCCN1C(c1cnn(C)c1)C(C)N.
What is the InChIKey of 1-(1-methylpyrazol-4-yl)-1-(2-propylpiperidin-1-yl)propan-2-amine?
The InChIKey is HOZWZUOKTBNFNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4/c1-4-7-14-8-5-6-9-19(14)15(12(2)16)13-10-17-18(3)11-13/h10-12,14-15H,4-9,16H2,1-3H3.
What are the key properties of 1-(1-methylpyrazol-4-yl)-1-(2-propylpiperidin-1-yl)propan-2-amine?
1-(1-methylpyrazol-4-yl)-1-(2-propylpiperidin-1-yl)propan-2-amine has a molecular weight of 264.42 g/mol, XLogP of 2.46, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylpyrazol-4-yl)-1-(2-propylpiperidin-1-yl)propan-2-amine is sourced from PubChem (CID 83052284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).