N-(1-piperidin-4-ylcyclopropyl)-5-(1H-pyrazol-4-yl)pyridine-2-carboxamide

C17H21N5O — CID 166261898

IUPACN-(1-piperidin-4-ylcyclopropyl)-5-(1H-pyrazol-4-yl)pyridine-2-carboxamide
SMILESO=C(NC1(C2CCNCC2)CC1)c1ccc(-c2cn[nH]c2)cn1
InChIInChI=1S/C17H21N5O/c23-16(22-17(5-6-17)14-3-7-18-8-4-14)15-2-1-12(9-19-15)13-10-20-21-11-13/h1-2,9-11,14,18H,3-8H2,(H,20,21)(H,22,23)
InChIKeyKZWQVIKSFNJSFS-UHFFFAOYSA-N
MW311.39 g/mol
LogP1.73
Rot. Bonds4

About N-(1-piperidin-4-ylcyclopropyl)-5-(1H-pyrazol-4-yl)pyridine-2-carboxamide

N-(1-piperidin-4-ylcyclopropyl)-5-(1H-pyrazol-4-yl)pyridine-2-carboxamide (PubChem CID 166261898) has the molecular formula C17H21N5O and a molecular weight of 311.39 g/mol. Its IUPAC name is N-(1-piperidin-4-ylcyclopropyl)-5-(1H-pyrazol-4-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(1-piperidin-4-ylcyclopropyl)-5-(1H-pyrazol-4-yl)pyridine-2-carboxamide
PubChem CID166261898
Molecular FormulaC17H21N5O
Molecular Weight311.39 g/mol
Exact Mass311.17
IUPAC NameN-(1-piperidin-4-ylcyclopropyl)-5-(1H-pyrazol-4-yl)pyridine-2-carboxamide
SMILESO=C(NC1(C2CCNCC2)CC1)c1ccc(-c2cn[nH]c2)cn1
InChIInChI=1S/C17H21N5O/c23-16(22-17(5-6-17)14-3-7-18-8-4-14)15-2-1-12(9-19-15)13-10-20-21-11-13/h1-2,9-11,14,18H,3-8H2,(H,20,21)(H,22,23)
InChIKeyKZWQVIKSFNJSFS-UHFFFAOYSA-N
XLogP1.73
TPSA82.70 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.39
LogP ≤ 51.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-piperidin-4-ylcyclopropyl)-5-(1H-pyrazol-4-yl)pyridine-2-carboxamide?
The IUPAC name of N-(1-piperidin-4-ylcyclopropyl)-5-(1H-pyrazol-4-yl)pyridine-2-carboxamide (CID 166261898) is N-(1-piperidin-4-ylcyclopropyl)-5-(1H-pyrazol-4-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-(1-piperidin-4-ylcyclopropyl)-5-(1H-pyrazol-4-yl)pyridine-2-carboxamide?
The canonical SMILES for N-(1-piperidin-4-ylcyclopropyl)-5-(1H-pyrazol-4-yl)pyridine-2-carboxamide is O=C(NC1(C2CCNCC2)CC1)c1ccc(-c2cn[nH]c2)cn1.
What is the InChIKey of N-(1-piperidin-4-ylcyclopropyl)-5-(1H-pyrazol-4-yl)pyridine-2-carboxamide?
The InChIKey is KZWQVIKSFNJSFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5O/c23-16(22-17(5-6-17)14-3-7-18-8-4-14)15-2-1-12(9-19-15)13-10-20-21-11-13/h1-2,9-11,14,18H,3-8H2,(H,20,21)(H,22,23).
What are the key properties of N-(1-piperidin-4-ylcyclopropyl)-5-(1H-pyrazol-4-yl)pyridine-2-carboxamide?
N-(1-piperidin-4-ylcyclopropyl)-5-(1H-pyrazol-4-yl)pyridine-2-carboxamide has a molecular weight of 311.39 g/mol, XLogP of 1.73, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-piperidin-4-ylcyclopropyl)-5-(1H-pyrazol-4-yl)pyridine-2-carboxamide is sourced from PubChem (CID 166261898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).