1-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]pyrazol-3-amine

C14H26N4 — CID 114251787

IUPAC1-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]pyrazol-3-amine
SMILESCCN1CCC(C(C)Nc2ccn(CC)n2)CC1
InChIInChI=1S/C14H26N4/c1-4-17-9-6-13(7-10-17)12(3)15-14-8-11-18(5-2)16-14/h8,11-13H,4-7,9-10H2,1-3H3,(H,15,16)
InChIKeyNTPVEXMZOXXWDT-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.44
Rot. Bonds5

About 1-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]pyrazol-3-amine

1-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]pyrazol-3-amine (PubChem CID 114251787) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is 1-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]pyrazol-3-amine.

Molecular Properties

Compound Name1-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]pyrazol-3-amine
PubChem CID114251787
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC Name1-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]pyrazol-3-amine
SMILESCCN1CCC(C(C)Nc2ccn(CC)n2)CC1
InChIInChI=1S/C14H26N4/c1-4-17-9-6-13(7-10-17)12(3)15-14-8-11-18(5-2)16-14/h8,11-13H,4-7,9-10H2,1-3H3,(H,15,16)
InChIKeyNTPVEXMZOXXWDT-UHFFFAOYSA-N
XLogP2.44
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]pyrazol-3-amine?
The IUPAC name of 1-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]pyrazol-3-amine (CID 114251787) is 1-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]pyrazol-3-amine.
What is the SMILES notation for 1-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]pyrazol-3-amine?
The canonical SMILES for 1-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]pyrazol-3-amine is CCN1CCC(C(C)Nc2ccn(CC)n2)CC1.
What is the InChIKey of 1-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]pyrazol-3-amine?
The InChIKey is NTPVEXMZOXXWDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-4-17-9-6-13(7-10-17)12(3)15-14-8-11-18(5-2)16-14/h8,11-13H,4-7,9-10H2,1-3H3,(H,15,16).
What are the key properties of 1-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]pyrazol-3-amine?
1-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]pyrazol-3-amine has a molecular weight of 250.39 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[1-(1-ethylpiperidin-4-yl)ethyl]pyrazol-3-amine is sourced from PubChem (CID 114251787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).