2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)acetamide

C13H23N5O2 — CID 61115720

IUPAC2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)acetamide
SMILESCN1CCC(N(CCO)C(=O)Cn2cc(N)cn2)CC1
InChIInChI=1S/C13H23N5O2/c1-16-4-2-12(3-5-16)18(6-7-19)13(20)10-17-9-11(14)8-15-17/h8-9,12,19H,2-7,10,14H2,1H3
InChIKeyYSOBPDDBKLQXCR-UHFFFAOYSA-N
MW281.36 g/mol
LogP-0.62
Rot. Bonds5

About 2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)acetamide

2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)acetamide (PubChem CID 61115720) has the molecular formula C13H23N5O2 and a molecular weight of 281.36 g/mol. Its IUPAC name is 2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)acetamide.

Molecular Properties

Compound Name2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)acetamide
PubChem CID61115720
Molecular FormulaC13H23N5O2
Molecular Weight281.36 g/mol
Exact Mass281.19
IUPAC Name2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)acetamide
SMILESCN1CCC(N(CCO)C(=O)Cn2cc(N)cn2)CC1
InChIInChI=1S/C13H23N5O2/c1-16-4-2-12(3-5-16)18(6-7-19)13(20)10-17-9-11(14)8-15-17/h8-9,12,19H,2-7,10,14H2,1H3
InChIKeyYSOBPDDBKLQXCR-UHFFFAOYSA-N
XLogP-0.62
TPSA87.62 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 5-0.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-(4-aminopyrazol-1-yl)-N-cyclopropyl-N-propylacetamide
CID 43445497
2-(4-aminopyrazol-1-yl)-N-cyclopropyl-N-ethylacetamide
CID 43445485
2-(4-aminopyrazol-1-yl)-N-(1,1-dioxothiolan-3-yl)-N-(2-methoxyethyl)acetamide
CID 61140908
N-(2-amino-2-oxoethyl)-2-(4-aminopyrazol-1-yl)-N-cyclopentylacetamide
CID 61110215
2-(4-aminopyrazol-1-yl)-N,N-dipropylacetamide
CID 43445164
2-(4-aminopyrazol-1-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide
CID 114514841
2-(4-aminopyrazol-1-yl)-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)acetamide
CID 107477873
2-amino-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)benzamide
CID 60959224
3-amino-4-fluoro-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)benzamide
CID 61115533
2-(4-aminopyrazol-1-yl)-N-methyl-N-(2-methylpropyl)acetamide
CID 43445500
2-(4-aminopyrazol-1-yl)-1-[3-(2-hydroxyethyl)pyrrolidin-1-yl]ethanone
CID 114796728
2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)acetamide
CID 43445471

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)acetamide?
The IUPAC name of 2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)acetamide (CID 61115720) is 2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)acetamide.
What is the SMILES notation for 2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)acetamide?
The canonical SMILES for 2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)acetamide is CN1CCC(N(CCO)C(=O)Cn2cc(N)cn2)CC1.
What is the InChIKey of 2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)acetamide?
The InChIKey is YSOBPDDBKLQXCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O2/c1-16-4-2-12(3-5-16)18(6-7-19)13(20)10-17-9-11(14)8-15-17/h8-9,12,19H,2-7,10,14H2,1H3.
What are the key properties of 2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)acetamide?
2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)acetamide has a molecular weight of 281.36 g/mol, XLogP of -0.62, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)-N-(1-methylpiperidin-4-yl)acetamide is sourced from PubChem (CID 61115720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).