N-(1-ethylpyrazol-4-yl)-1-pyridin-4-ylpiperidin-4-amine

C15H21N5 — CID 43543272

IUPACN-(1-ethylpyrazol-4-yl)-1-pyridin-4-ylpiperidin-4-amine
SMILESCCn1cc(NC2CCN(c3ccncc3)CC2)cn1
InChIInChI=1S/C15H21N5/c1-2-20-12-14(11-17-20)18-13-5-9-19(10-6-13)15-3-7-16-8-4-15/h3-4,7-8,11-13,18H,2,5-6,9-10H2,1H3
InChIKeyRHAWGPHEYMASFP-UHFFFAOYSA-N
MW271.37 g/mol
LogP2.38
Rot. Bonds4

About N-(1-ethylpyrazol-4-yl)-1-pyridin-4-ylpiperidin-4-amine

N-(1-ethylpyrazol-4-yl)-1-pyridin-4-ylpiperidin-4-amine (PubChem CID 43543272) has the molecular formula C15H21N5 and a molecular weight of 271.37 g/mol. Its IUPAC name is N-(1-ethylpyrazol-4-yl)-1-pyridin-4-ylpiperidin-4-amine.

Molecular Properties

Compound NameN-(1-ethylpyrazol-4-yl)-1-pyridin-4-ylpiperidin-4-amine
PubChem CID43543272
Molecular FormulaC15H21N5
Molecular Weight271.37 g/mol
Exact Mass271.18
IUPAC NameN-(1-ethylpyrazol-4-yl)-1-pyridin-4-ylpiperidin-4-amine
SMILESCCn1cc(NC2CCN(c3ccncc3)CC2)cn1
InChIInChI=1S/C15H21N5/c1-2-20-12-14(11-17-20)18-13-5-9-19(10-6-13)15-3-7-16-8-4-15/h3-4,7-8,11-13,18H,2,5-6,9-10H2,1H3
InChIKeyRHAWGPHEYMASFP-UHFFFAOYSA-N
XLogP2.38
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.37
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpyrazol-4-yl)-1-pyridin-4-ylpiperidin-4-amine?
The IUPAC name of N-(1-ethylpyrazol-4-yl)-1-pyridin-4-ylpiperidin-4-amine (CID 43543272) is N-(1-ethylpyrazol-4-yl)-1-pyridin-4-ylpiperidin-4-amine.
What is the SMILES notation for N-(1-ethylpyrazol-4-yl)-1-pyridin-4-ylpiperidin-4-amine?
The canonical SMILES for N-(1-ethylpyrazol-4-yl)-1-pyridin-4-ylpiperidin-4-amine is CCn1cc(NC2CCN(c3ccncc3)CC2)cn1.
What is the InChIKey of N-(1-ethylpyrazol-4-yl)-1-pyridin-4-ylpiperidin-4-amine?
The InChIKey is RHAWGPHEYMASFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5/c1-2-20-12-14(11-17-20)18-13-5-9-19(10-6-13)15-3-7-16-8-4-15/h3-4,7-8,11-13,18H,2,5-6,9-10H2,1H3.
What are the key properties of N-(1-ethylpyrazol-4-yl)-1-pyridin-4-ylpiperidin-4-amine?
N-(1-ethylpyrazol-4-yl)-1-pyridin-4-ylpiperidin-4-amine has a molecular weight of 271.37 g/mol, XLogP of 2.38, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpyrazol-4-yl)-1-pyridin-4-ylpiperidin-4-amine is sourced from PubChem (CID 43543272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).