1-(4-amino-1-methyl-3-propylpyrazol-5-yl)-N-methylpiperidine-4-carboxamide

C14H25N5O — CID 66017883

IUPAC1-(4-amino-1-methyl-3-propylpyrazol-5-yl)-N-methylpiperidine-4-carboxamide
SMILESCCCc1nn(C)c(N2CCC(C(=O)NC)CC2)c1N
InChIInChI=1S/C14H25N5O/c1-4-5-11-12(15)14(18(3)17-11)19-8-6-10(7-9-19)13(20)16-2/h10H,4-9,15H2,1-3H3,(H,16,20)
InChIKeyVXULSOBSDGQXIW-UHFFFAOYSA-N
MW279.39 g/mol
LogP0.92
Rot. Bonds4

About 1-(4-amino-1-methyl-3-propylpyrazol-5-yl)-N-methylpiperidine-4-carboxamide

1-(4-amino-1-methyl-3-propylpyrazol-5-yl)-N-methylpiperidine-4-carboxamide (PubChem CID 66017883) has the molecular formula C14H25N5O and a molecular weight of 279.39 g/mol. Its IUPAC name is 1-(4-amino-1-methyl-3-propylpyrazol-5-yl)-N-methylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(4-amino-1-methyl-3-propylpyrazol-5-yl)-N-methylpiperidine-4-carboxamide
PubChem CID66017883
Molecular FormulaC14H25N5O
Molecular Weight279.39 g/mol
Exact Mass279.21
IUPAC Name1-(4-amino-1-methyl-3-propylpyrazol-5-yl)-N-methylpiperidine-4-carboxamide
SMILESCCCc1nn(C)c(N2CCC(C(=O)NC)CC2)c1N
InChIInChI=1S/C14H25N5O/c1-4-5-11-12(15)14(18(3)17-11)19-8-6-10(7-9-19)13(20)16-2/h10H,4-9,15H2,1-3H3,(H,16,20)
InChIKeyVXULSOBSDGQXIW-UHFFFAOYSA-N
XLogP0.92
TPSA76.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[4-(4-amino-1-methyl-3-propylpyrazol-5-yl)piperazin-1-yl]ethanone
CID 66018435
5-[4-(cyclopropylmethyl)piperazin-1-yl]-1-methyl-3-propylpyrazol-4-amine
CID 66018866
1-methyl-5-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-3-propylpyrazol-4-amine
CID 79174452
1-methyl-5-(4-methyl-1,4-diazepan-1-yl)-3-propylpyrazol-4-amine
CID 66018437
5-(4,4-dimethylazepan-1-yl)-1-methyl-3-propylpyrazol-4-amine
CID 66019488
5-[3-(methoxymethyl)pyrrolidin-1-yl]-1-methyl-3-propylpyrazol-4-amine
CID 66018904
[1-(4-amino-1-methyl-3-propylpyrazol-5-yl)piperidin-3-yl]methanol
CID 66020017
N-[[1-(4-amino-3-ethyl-1-methylpyrazol-5-yl)piperidin-4-yl]methyl]acetamide
CID 102735928
1-(4-amino-1-methyl-3-propylpyrazol-5-yl)-N-methylpyrazole-3-carboxamide
CID 66018138
1-methyl-5-(3-morpholin-4-ylpyrrolidin-1-yl)-3-propylpyrazol-4-amine
CID 66018117
5-(3-ethyl-4-methylpiperazin-1-yl)-1-methyl-3-propylpyrazol-4-amine
CID 66018899
3-ethyl-1-methyl-5-(4-propylazepan-1-yl)pyrazol-4-amine
CID 66013850

Frequently Asked Questions

What is the IUPAC name of 1-(4-amino-1-methyl-3-propylpyrazol-5-yl)-N-methylpiperidine-4-carboxamide?
The IUPAC name of 1-(4-amino-1-methyl-3-propylpyrazol-5-yl)-N-methylpiperidine-4-carboxamide (CID 66017883) is 1-(4-amino-1-methyl-3-propylpyrazol-5-yl)-N-methylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(4-amino-1-methyl-3-propylpyrazol-5-yl)-N-methylpiperidine-4-carboxamide?
The canonical SMILES for 1-(4-amino-1-methyl-3-propylpyrazol-5-yl)-N-methylpiperidine-4-carboxamide is CCCc1nn(C)c(N2CCC(C(=O)NC)CC2)c1N.
What is the InChIKey of 1-(4-amino-1-methyl-3-propylpyrazol-5-yl)-N-methylpiperidine-4-carboxamide?
The InChIKey is VXULSOBSDGQXIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O/c1-4-5-11-12(15)14(18(3)17-11)19-8-6-10(7-9-19)13(20)16-2/h10H,4-9,15H2,1-3H3,(H,16,20).
What are the key properties of 1-(4-amino-1-methyl-3-propylpyrazol-5-yl)-N-methylpiperidine-4-carboxamide?
1-(4-amino-1-methyl-3-propylpyrazol-5-yl)-N-methylpiperidine-4-carboxamide has a molecular weight of 279.39 g/mol, XLogP of 0.92, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-amino-1-methyl-3-propylpyrazol-5-yl)-N-methylpiperidine-4-carboxamide is sourced from PubChem (CID 66017883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).