6-amino-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]pyridine-3-carboxamide

C14H17N5O — CID 91762623

IUPAC6-amino-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]pyridine-3-carboxamide
SMILESNc1ccc(C(=O)NCC2(Cn3cccn3)CC2)cn1
InChIInChI=1S/C14H17N5O/c15-12-3-2-11(8-16-12)13(20)17-9-14(4-5-14)10-19-7-1-6-18-19/h1-3,6-8H,4-5,9-10H2,(H2,15,16)(H,17,20)
InChIKeyRFFLMWIYZZLJQG-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.07
Rot. Bonds5

About 6-amino-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]pyridine-3-carboxamide

6-amino-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]pyridine-3-carboxamide (PubChem CID 91762623) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is 6-amino-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]pyridine-3-carboxamide
PubChem CID91762623
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC Name6-amino-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]pyridine-3-carboxamide
SMILESNc1ccc(C(=O)NCC2(Cn3cccn3)CC2)cn1
InChIInChI=1S/C14H17N5O/c15-12-3-2-11(8-16-12)13(20)17-9-14(4-5-14)10-19-7-1-6-18-19/h1-3,6-8H,4-5,9-10H2,(H2,15,16)(H,17,20)
InChIKeyRFFLMWIYZZLJQG-UHFFFAOYSA-N
XLogP1.07
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]pyridine-3-carboxamide?
The IUPAC name of 6-amino-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]pyridine-3-carboxamide (CID 91762623) is 6-amino-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-amino-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]pyridine-3-carboxamide?
The canonical SMILES for 6-amino-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]pyridine-3-carboxamide is Nc1ccc(C(=O)NCC2(Cn3cccn3)CC2)cn1.
What is the InChIKey of 6-amino-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]pyridine-3-carboxamide?
The InChIKey is RFFLMWIYZZLJQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c15-12-3-2-11(8-16-12)13(20)17-9-14(4-5-14)10-19-7-1-6-18-19/h1-3,6-8H,4-5,9-10H2,(H2,15,16)(H,17,20).
What are the key properties of 6-amino-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]pyridine-3-carboxamide?
6-amino-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]pyridine-3-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 1.07, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]pyridine-3-carboxamide is sourced from PubChem (CID 91762623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).