1-[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-N-methylpiperidine-3-carboxamide

C13H23N5O2 — CID 103194660

IUPAC1-[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-N-methylpiperidine-3-carboxamide
SMILESCNC(=O)C1CCCN(CC(O)Cn2cc(N)cn2)C1
InChIInChI=1S/C13H23N5O2/c1-15-13(20)10-3-2-4-17(6-10)8-12(19)9-18-7-11(14)5-16-18/h5,7,10,12,19H,2-4,6,8-9,14H2,1H3,(H,15,20)
InChIKeyZYYDRWWVVYZKIZ-UHFFFAOYSA-N
MW281.36 g/mol
LogP-0.72
Rot. Bonds5

About 1-[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-N-methylpiperidine-3-carboxamide

1-[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-N-methylpiperidine-3-carboxamide (PubChem CID 103194660) has the molecular formula C13H23N5O2 and a molecular weight of 281.36 g/mol. Its IUPAC name is 1-[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-N-methylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-N-methylpiperidine-3-carboxamide
PubChem CID103194660
Molecular FormulaC13H23N5O2
Molecular Weight281.36 g/mol
Exact Mass281.19
IUPAC Name1-[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-N-methylpiperidine-3-carboxamide
SMILESCNC(=O)C1CCCN(CC(O)Cn2cc(N)cn2)C1
InChIInChI=1S/C13H23N5O2/c1-15-13(20)10-3-2-4-17(6-10)8-12(19)9-18-7-11(14)5-16-18/h5,7,10,12,19H,2-4,6,8-9,14H2,1H3,(H,15,20)
InChIKeyZYYDRWWVVYZKIZ-UHFFFAOYSA-N
XLogP-0.72
TPSA96.41 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 5-0.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

1-(4-aminopyrazol-1-yl)-3-(3-ethylpiperidin-1-yl)propan-2-ol
CID 43584180
(2S)-1-(4-aminopyrazol-1-yl)-3-pyrrolidin-1-ylpropan-2-ol
CID 51864183
1-(4-aminopyrazol-1-yl)-3-(azepan-1-yl)propan-2-ol
CID 43369877
1-(4-aminopyrazol-1-yl)-3-(4-methylazepan-1-yl)propan-2-ol
CID 63623491
1-(4-aminopyrazol-1-yl)-3-[3-(2-hydroxyethyl)pyrrolidin-1-yl]propan-2-ol
CID 114797096
1-(4-aminopyrazol-1-yl)-3-(4-cyclopentylpiperazin-1-yl)propan-2-ol
CID 62368592
4-[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-N-methylmorpholine-3-carboxamide
CID 83106929
1-[3-(4-chlorophenoxy)-2-hydroxypropyl]-N-methylpiperidine-3-carboxamide
CID 111113624
1-(3-butoxy-2-hydroxypropyl)-N-methylpiperidine-3-carboxamide
CID 107263994
ethyl (3S)-1-[(2R)-2-hydroxy-3-pyrazol-1-ylpropyl]piperidine-3-carboxylate
CID 99819039
4-[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-N-ethylmorpholine-3-carboxamide
CID 83097772
1-benzyl-N-methylpiperidine-3-carboxamide
CID 43918327

Frequently Asked Questions

What is the IUPAC name of 1-[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-N-methylpiperidine-3-carboxamide?
The IUPAC name of 1-[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-N-methylpiperidine-3-carboxamide (CID 103194660) is 1-[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-N-methylpiperidine-3-carboxamide.
What is the SMILES notation for 1-[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-N-methylpiperidine-3-carboxamide?
The canonical SMILES for 1-[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-N-methylpiperidine-3-carboxamide is CNC(=O)C1CCCN(CC(O)Cn2cc(N)cn2)C1.
What is the InChIKey of 1-[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-N-methylpiperidine-3-carboxamide?
The InChIKey is ZYYDRWWVVYZKIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O2/c1-15-13(20)10-3-2-4-17(6-10)8-12(19)9-18-7-11(14)5-16-18/h5,7,10,12,19H,2-4,6,8-9,14H2,1H3,(H,15,20).
What are the key properties of 1-[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-N-methylpiperidine-3-carboxamide?
1-[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-N-methylpiperidine-3-carboxamide has a molecular weight of 281.36 g/mol, XLogP of -0.72, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(4-aminopyrazol-1-yl)-2-hydroxypropyl]-N-methylpiperidine-3-carboxamide is sourced from PubChem (CID 103194660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).