1-[6-(aminomethyl)-3-pyridinyl]pyrazole-3-carboxamide

C10H11N5O — CID 115487131

IUPAC1-[6-(aminomethyl)-3-pyridinyl]pyrazole-3-carboxamide
SMILESNCc1ccc(-n2ccc(C(N)=O)n2)cn1
InChIInChI=1S/C10H11N5O/c11-5-7-1-2-8(6-13-7)15-4-3-9(14-15)10(12)16/h1-4,6H,5,11H2,(H2,12,16)
InChIKeyOBWKRSBUCHYJMX-UHFFFAOYSA-N
MW217.23 g/mol
LogP-0.18
Rot. Bonds3

About 1-[6-(aminomethyl)-3-pyridinyl]pyrazole-3-carboxamide

1-[6-(aminomethyl)-3-pyridinyl]pyrazole-3-carboxamide (PubChem CID 115487131) has the molecular formula C10H11N5O and a molecular weight of 217.23 g/mol. Its IUPAC name is 1-[6-(aminomethyl)-3-pyridinyl]pyrazole-3-carboxamide.

Molecular Properties

Compound Name1-[6-(aminomethyl)-3-pyridinyl]pyrazole-3-carboxamide
PubChem CID115487131
Molecular FormulaC10H11N5O
Molecular Weight217.23 g/mol
Exact Mass217.10
IUPAC Name1-[6-(aminomethyl)-3-pyridinyl]pyrazole-3-carboxamide
SMILESNCc1ccc(-n2ccc(C(N)=O)n2)cn1
InChIInChI=1S/C10H11N5O/c11-5-7-1-2-8(6-13-7)15-4-3-9(14-15)10(12)16/h1-4,6H,5,11H2,(H2,12,16)
InChIKeyOBWKRSBUCHYJMX-UHFFFAOYSA-N
XLogP-0.18
TPSA99.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.23
LogP ≤ 5-0.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-[6-(1-aminoethyl)-3-pyridinyl]pyrazole-3-carboxamide
CID 83127909
1-(4-aminophenyl)pyrazole-3-carboxamide
CID 25247604
1-[4-(aminomethyl)-3-bromophenyl]pyrazole-3-carboxamide
CID 107275115
1-[4-(3-fluoropropoxy)phenyl]pyrazole-3-carboxamide
CID 141144470
[5-[3-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]methanamine
CID 113320436
1-(4-carbamothioylphenyl)pyrazole-3-carboxamide
CID 64782843
1-[2-(aminomethyl)phenyl]pyrazole-3-carboxamide
CID 64782828
1-[4-(aminomethyl)-6-methylpyrimidin-2-yl]pyrazole-3-carboxamide
CID 107542386
1-(triazolo[1,5-a]pyridin-6-yl)pyrazole-3-carboxamide
CID 175781516
1-[2-(aminomethyl)-6-methylphenyl]pyrazole-3-carboxamide
CID 107105885
1-[6-(1-aminoethyl)-3-pyridinyl]-N-methylpyrazole-3-carboxamide
CID 83127022
1-[5-(aminomethyl)-2-methylphenyl]pyrazole-3-carboxamide
CID 105406365

Frequently Asked Questions

What is the IUPAC name of 1-[6-(aminomethyl)-3-pyridinyl]pyrazole-3-carboxamide?
The IUPAC name of 1-[6-(aminomethyl)-3-pyridinyl]pyrazole-3-carboxamide (CID 115487131) is 1-[6-(aminomethyl)-3-pyridinyl]pyrazole-3-carboxamide.
What is the SMILES notation for 1-[6-(aminomethyl)-3-pyridinyl]pyrazole-3-carboxamide?
The canonical SMILES for 1-[6-(aminomethyl)-3-pyridinyl]pyrazole-3-carboxamide is NCc1ccc(-n2ccc(C(N)=O)n2)cn1.
What is the InChIKey of 1-[6-(aminomethyl)-3-pyridinyl]pyrazole-3-carboxamide?
The InChIKey is OBWKRSBUCHYJMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5O/c11-5-7-1-2-8(6-13-7)15-4-3-9(14-15)10(12)16/h1-4,6H,5,11H2,(H2,12,16).
What are the key properties of 1-[6-(aminomethyl)-3-pyridinyl]pyrazole-3-carboxamide?
1-[6-(aminomethyl)-3-pyridinyl]pyrazole-3-carboxamide has a molecular weight of 217.23 g/mol, XLogP of -0.18, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(aminomethyl)-3-pyridinyl]pyrazole-3-carboxamide is sourced from PubChem (CID 115487131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).