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

C13H24N4 — CID 43534725

IUPACN-[1-(1-ethylpiperidin-4-yl)ethyl]-1-methylpyrazol-4-amine
SMILESCCN1CCC(C(C)Nc2cnn(C)c2)CC1
InChIInChI=1S/C13H24N4/c1-4-17-7-5-12(6-8-17)11(2)15-13-9-14-16(3)10-13/h9-12,15H,4-8H2,1-3H3
InChIKeyKUDGYQXWJNNMNO-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.95
Rot. Bonds4

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

N-[1-(1-ethylpiperidin-4-yl)ethyl]-1-methylpyrazol-4-amine (PubChem CID 43534725) has the molecular formula C13H24N4 and a molecular weight of 236.36 g/mol. Its IUPAC name is N-[1-(1-ethylpiperidin-4-yl)ethyl]-1-methylpyrazol-4-amine.

Molecular Properties

Compound NameN-[1-(1-ethylpiperidin-4-yl)ethyl]-1-methylpyrazol-4-amine
PubChem CID43534725
Molecular FormulaC13H24N4
Molecular Weight236.36 g/mol
Exact Mass236.20
IUPAC NameN-[1-(1-ethylpiperidin-4-yl)ethyl]-1-methylpyrazol-4-amine
SMILESCCN1CCC(C(C)Nc2cnn(C)c2)CC1
InChIInChI=1S/C13H24N4/c1-4-17-7-5-12(6-8-17)11(2)15-13-9-14-16(3)10-13/h9-12,15H,4-8H2,1-3H3
InChIKeyKUDGYQXWJNNMNO-UHFFFAOYSA-N
XLogP1.95
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(1-ethylpiperidin-4-yl)ethyl]-1-methylpyrazol-4-amine?
The IUPAC name of N-[1-(1-ethylpiperidin-4-yl)ethyl]-1-methylpyrazol-4-amine (CID 43534725) is N-[1-(1-ethylpiperidin-4-yl)ethyl]-1-methylpyrazol-4-amine.
What is the SMILES notation for N-[1-(1-ethylpiperidin-4-yl)ethyl]-1-methylpyrazol-4-amine?
The canonical SMILES for N-[1-(1-ethylpiperidin-4-yl)ethyl]-1-methylpyrazol-4-amine is CCN1CCC(C(C)Nc2cnn(C)c2)CC1.
What is the InChIKey of N-[1-(1-ethylpiperidin-4-yl)ethyl]-1-methylpyrazol-4-amine?
The InChIKey is KUDGYQXWJNNMNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4/c1-4-17-7-5-12(6-8-17)11(2)15-13-9-14-16(3)10-13/h9-12,15H,4-8H2,1-3H3.
What are the key properties of N-[1-(1-ethylpiperidin-4-yl)ethyl]-1-methylpyrazol-4-amine?
N-[1-(1-ethylpiperidin-4-yl)ethyl]-1-methylpyrazol-4-amine has a molecular weight of 236.36 g/mol, XLogP of 1.95, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-ethylpiperidin-4-yl)ethyl]-1-methylpyrazol-4-amine is sourced from PubChem (CID 43534725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).