1-(3-ethyl-1-methylpyrazol-4-yl)-3-methyl-N-propylpiperidin-4-amine

C15H28N4 — CID 107463331

IUPAC1-(3-ethyl-1-methylpyrazol-4-yl)-3-methyl-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(c2cn(C)nc2CC)CC1C
InChIInChI=1S/C15H28N4/c1-5-8-16-14-7-9-19(10-12(14)3)15-11-18(4)17-13(15)6-2/h11-12,14,16H,5-10H2,1-4H3
InChIKeyQVKTZOXUSJZBEE-UHFFFAOYSA-N
MW264.42 g/mol
LogP2.20
Rot. Bonds5

About 1-(3-ethyl-1-methylpyrazol-4-yl)-3-methyl-N-propylpiperidin-4-amine

1-(3-ethyl-1-methylpyrazol-4-yl)-3-methyl-N-propylpiperidin-4-amine (PubChem CID 107463331) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is 1-(3-ethyl-1-methylpyrazol-4-yl)-3-methyl-N-propylpiperidin-4-amine.

Molecular Properties

Compound Name1-(3-ethyl-1-methylpyrazol-4-yl)-3-methyl-N-propylpiperidin-4-amine
PubChem CID107463331
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC Name1-(3-ethyl-1-methylpyrazol-4-yl)-3-methyl-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(c2cn(C)nc2CC)CC1C
InChIInChI=1S/C15H28N4/c1-5-8-16-14-7-9-19(10-12(14)3)15-11-18(4)17-13(15)6-2/h11-12,14,16H,5-10H2,1-4H3
InChIKeyQVKTZOXUSJZBEE-UHFFFAOYSA-N
XLogP2.20
TPSA33.09 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 ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-ethyl-1-methylpyrazol-4-yl)-N,3-dimethylpiperidin-4-amine
CID 107463346
[1-(3-ethyl-1-methylpyrazol-4-yl)pyrrolidin-3-yl]methanol
CID 107464849
1-(3-ethyl-1-methylpyrazol-4-yl)piperidin-4-amine
CID 107463343
1-(1,3-dimethylpyrazol-4-yl)-N-propylpyrrolidin-3-amine
CID 102805781
1-(2,5-dichloro-4-methylphenyl)-3-methyl-N-propylpiperidin-4-amine
CID 104727298
3-methyl-1-(4-methylphenyl)-N-propylpiperidin-4-amine
CID 54975533
3-methyl-N-propyl-1-thiophen-3-ylpiperidin-4-amine
CID 66349971
1-(4-bromophenyl)-3-methyl-N-propylpiperidin-4-amine
CID 54975299
[4-(ethylamino)-3-methylpiperidin-1-yl]-(3-ethyl-1-methylpyrazol-4-yl)methanone
CID 102809877
1-[2-(2-methoxyethyl)phenyl]-3-methyl-N-propylpiperidin-4-amine
CID 102906308
N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-2-methylcyclopentan-1-amine
CID 112549510
1-(3-iodophenyl)-3-methyl-N-propylpiperidin-4-amine
CID 54976134

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethyl-1-methylpyrazol-4-yl)-3-methyl-N-propylpiperidin-4-amine?
The IUPAC name of 1-(3-ethyl-1-methylpyrazol-4-yl)-3-methyl-N-propylpiperidin-4-amine (CID 107463331) is 1-(3-ethyl-1-methylpyrazol-4-yl)-3-methyl-N-propylpiperidin-4-amine.
What is the SMILES notation for 1-(3-ethyl-1-methylpyrazol-4-yl)-3-methyl-N-propylpiperidin-4-amine?
The canonical SMILES for 1-(3-ethyl-1-methylpyrazol-4-yl)-3-methyl-N-propylpiperidin-4-amine is CCCNC1CCN(c2cn(C)nc2CC)CC1C.
What is the InChIKey of 1-(3-ethyl-1-methylpyrazol-4-yl)-3-methyl-N-propylpiperidin-4-amine?
The InChIKey is QVKTZOXUSJZBEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4/c1-5-8-16-14-7-9-19(10-12(14)3)15-11-18(4)17-13(15)6-2/h11-12,14,16H,5-10H2,1-4H3.
What are the key properties of 1-(3-ethyl-1-methylpyrazol-4-yl)-3-methyl-N-propylpiperidin-4-amine?
1-(3-ethyl-1-methylpyrazol-4-yl)-3-methyl-N-propylpiperidin-4-amine has a molecular weight of 264.42 g/mol, XLogP of 2.20, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethyl-1-methylpyrazol-4-yl)-3-methyl-N-propylpiperidin-4-amine is sourced from PubChem (CID 107463331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).