1-(2-amino-2-oxoethyl)-N-[(1,5-dimethylindazol-3-yl)methyl]piperidine-4-carboxamide

C18H25N5O2 — CID 70751849

IUPAC1-(2-amino-2-oxoethyl)-N-[(1,5-dimethylindazol-3-yl)methyl]piperidine-4-carboxamide
SMILESCc1ccc2c(c1)c(CNC(=O)C1CCN(CC(N)=O)CC1)nn2C
InChIInChI=1S/C18H25N5O2/c1-12-3-4-16-14(9-12)15(21-22(16)2)10-20-18(25)13-5-7-23(8-6-13)11-17(19)24/h3-4,9,13H,5-8,10-11H2,1-2H3,(H2,19,24)(H,20,25)
InChIKeyDGJMAWXMCGTLGX-UHFFFAOYSA-N
MW343.43 g/mol
LogP0.70
Rot. Bonds5

About 1-(2-amino-2-oxoethyl)-N-[(1,5-dimethylindazol-3-yl)methyl]piperidine-4-carboxamide

1-(2-amino-2-oxoethyl)-N-[(1,5-dimethylindazol-3-yl)methyl]piperidine-4-carboxamide (PubChem CID 70751849) has the molecular formula C18H25N5O2 and a molecular weight of 343.43 g/mol. Its IUPAC name is 1-(2-amino-2-oxoethyl)-N-[(1,5-dimethylindazol-3-yl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-amino-2-oxoethyl)-N-[(1,5-dimethylindazol-3-yl)methyl]piperidine-4-carboxamide
PubChem CID70751849
Molecular FormulaC18H25N5O2
Molecular Weight343.43 g/mol
Exact Mass343.20
IUPAC Name1-(2-amino-2-oxoethyl)-N-[(1,5-dimethylindazol-3-yl)methyl]piperidine-4-carboxamide
SMILESCc1ccc2c(c1)c(CNC(=O)C1CCN(CC(N)=O)CC1)nn2C
InChIInChI=1S/C18H25N5O2/c1-12-3-4-16-14(9-12)15(21-22(16)2)10-20-18(25)13-5-7-23(8-6-13)11-17(19)24/h3-4,9,13H,5-8,10-11H2,1-2H3,(H2,19,24)(H,20,25)
InChIKeyDGJMAWXMCGTLGX-UHFFFAOYSA-N
XLogP0.70
TPSA93.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-2-oxoethyl)-N-[(1,5-dimethylindazol-3-yl)methyl]piperidine-4-carboxamide?
The IUPAC name of 1-(2-amino-2-oxoethyl)-N-[(1,5-dimethylindazol-3-yl)methyl]piperidine-4-carboxamide (CID 70751849) is 1-(2-amino-2-oxoethyl)-N-[(1,5-dimethylindazol-3-yl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-amino-2-oxoethyl)-N-[(1,5-dimethylindazol-3-yl)methyl]piperidine-4-carboxamide?
The canonical SMILES for 1-(2-amino-2-oxoethyl)-N-[(1,5-dimethylindazol-3-yl)methyl]piperidine-4-carboxamide is Cc1ccc2c(c1)c(CNC(=O)C1CCN(CC(N)=O)CC1)nn2C.
What is the InChIKey of 1-(2-amino-2-oxoethyl)-N-[(1,5-dimethylindazol-3-yl)methyl]piperidine-4-carboxamide?
The InChIKey is DGJMAWXMCGTLGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N5O2/c1-12-3-4-16-14(9-12)15(21-22(16)2)10-20-18(25)13-5-7-23(8-6-13)11-17(19)24/h3-4,9,13H,5-8,10-11H2,1-2H3,(H2,19,24)(H,20,25).
What are the key properties of 1-(2-amino-2-oxoethyl)-N-[(1,5-dimethylindazol-3-yl)methyl]piperidine-4-carboxamide?
1-(2-amino-2-oxoethyl)-N-[(1,5-dimethylindazol-3-yl)methyl]piperidine-4-carboxamide has a molecular weight of 343.43 g/mol, XLogP of 0.70, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-2-oxoethyl)-N-[(1,5-dimethylindazol-3-yl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 70751849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).