4-amino-N-ethyl-5-propyl-N-(pyridin-4-ylmethyl)-1H-pyrazole-3-carboxamide

C15H21N5O — CID 62076293

IUPAC4-amino-N-ethyl-5-propyl-N-(pyridin-4-ylmethyl)-1H-pyrazole-3-carboxamide
SMILESCCCc1[nH]nc(C(=O)N(CC)Cc2ccncc2)c1N
InChIInChI=1S/C15H21N5O/c1-3-5-12-13(16)14(19-18-12)15(21)20(4-2)10-11-6-8-17-9-7-11/h6-9H,3-5,10,16H2,1-2H3,(H,18,19)
InChIKeyYCMCPTKOPGWKHL-UHFFFAOYSA-N
MW287.37 g/mol
LogP2.00
Rot. Bonds6

About 4-amino-N-ethyl-5-propyl-N-(pyridin-4-ylmethyl)-1H-pyrazole-3-carboxamide

4-amino-N-ethyl-5-propyl-N-(pyridin-4-ylmethyl)-1H-pyrazole-3-carboxamide (PubChem CID 62076293) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 4-amino-N-ethyl-5-propyl-N-(pyridin-4-ylmethyl)-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-ethyl-5-propyl-N-(pyridin-4-ylmethyl)-1H-pyrazole-3-carboxamide
PubChem CID62076293
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name4-amino-N-ethyl-5-propyl-N-(pyridin-4-ylmethyl)-1H-pyrazole-3-carboxamide
SMILESCCCc1[nH]nc(C(=O)N(CC)Cc2ccncc2)c1N
InChIInChI=1S/C15H21N5O/c1-3-5-12-13(16)14(19-18-12)15(21)20(4-2)10-11-6-8-17-9-7-11/h6-9H,3-5,10,16H2,1-2H3,(H,18,19)
InChIKeyYCMCPTKOPGWKHL-UHFFFAOYSA-N
XLogP2.00
TPSA87.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N,N-diethyl-5-propyl-1H-pyrazole-3-carboxamide
CID 62075271
4-amino-5-cyclopropyl-N-ethyl-N-(pyridin-4-ylmethyl)-1H-pyrazole-3-carboxamide
CID 62079719
4-amino-N-methyl-5-propyl-N-(pyridin-2-ylmethyl)-1H-pyrazole-3-carboxamide
CID 62076095
4-amino-N-[2-(dimethylamino)ethyl]-N-methyl-5-propyl-1H-pyrazole-3-carboxamide
CID 63694582
4-amino-N,5-diethyl-N-pyridin-4-yl-1H-pyrazole-3-carboxamide
CID 106934374
4-amino-5-propyl-N-(1-pyridin-4-ylethyl)-1H-pyrazole-3-carboxamide
CID 62076755
4-amino-N-[(4-ethylphenyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide
CID 106899103
4-amino-5-cyclopropyl-N-methyl-N-(pyridin-4-ylmethyl)-1H-pyrazole-3-carboxamide
CID 62078609
4-amino-N-[(3-methyl-4-pyridinyl)methyl]-5-propyl-1H-pyrazole-3-carboxamide
CID 114698169
4-amino-N-ethyl-N-(pyridin-4-ylmethyl)-1H-pyrazolo[3,4-b]pyridine-5-carboxamide
CID 57218772
3-amino-N-ethyl-N-(pyridin-4-ylmethyl)benzamide
CID 54905832
4-amino-N,N-dibutyl-5-ethyl-1H-pyrazole-3-carboxamide
CID 62080934

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-ethyl-5-propyl-N-(pyridin-4-ylmethyl)-1H-pyrazole-3-carboxamide?
The IUPAC name of 4-amino-N-ethyl-5-propyl-N-(pyridin-4-ylmethyl)-1H-pyrazole-3-carboxamide (CID 62076293) is 4-amino-N-ethyl-5-propyl-N-(pyridin-4-ylmethyl)-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-ethyl-5-propyl-N-(pyridin-4-ylmethyl)-1H-pyrazole-3-carboxamide?
The canonical SMILES for 4-amino-N-ethyl-5-propyl-N-(pyridin-4-ylmethyl)-1H-pyrazole-3-carboxamide is CCCc1[nH]nc(C(=O)N(CC)Cc2ccncc2)c1N.
What is the InChIKey of 4-amino-N-ethyl-5-propyl-N-(pyridin-4-ylmethyl)-1H-pyrazole-3-carboxamide?
The InChIKey is YCMCPTKOPGWKHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-3-5-12-13(16)14(19-18-12)15(21)20(4-2)10-11-6-8-17-9-7-11/h6-9H,3-5,10,16H2,1-2H3,(H,18,19).
What are the key properties of 4-amino-N-ethyl-5-propyl-N-(pyridin-4-ylmethyl)-1H-pyrazole-3-carboxamide?
4-amino-N-ethyl-5-propyl-N-(pyridin-4-ylmethyl)-1H-pyrazole-3-carboxamide has a molecular weight of 287.37 g/mol, XLogP of 2.00, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-ethyl-5-propyl-N-(pyridin-4-ylmethyl)-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 62076293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).