1-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]cyclopropan-1-amine

C12H20N4 — CID 84787606

IUPAC1-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]cyclopropan-1-amine
SMILESCN1CCC(n2cc(C3(N)CC3)cn2)CC1
InChIInChI=1S/C12H20N4/c1-15-6-2-11(3-7-15)16-9-10(8-14-16)12(13)4-5-12/h8-9,11H,2-7,13H2,1H3
InChIKeyCFLFZGFYPJCTHI-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.10
Rot. Bonds2

About 1-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]cyclopropan-1-amine

1-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]cyclopropan-1-amine (PubChem CID 84787606) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 1-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]cyclopropan-1-amine
PubChem CID84787606
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name1-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]cyclopropan-1-amine
SMILESCN1CCC(n2cc(C3(N)CC3)cn2)CC1
InChIInChI=1S/C12H20N4/c1-15-6-2-11(3-7-15)16-9-10(8-14-16)12(13)4-5-12/h8-9,11H,2-7,13H2,1H3
InChIKeyCFLFZGFYPJCTHI-UHFFFAOYSA-N
XLogP1.10
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]cyclopropan-1-amine?
The IUPAC name of 1-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]cyclopropan-1-amine (CID 84787606) is 1-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]cyclopropan-1-amine.
What is the SMILES notation for 1-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]cyclopropan-1-amine?
The canonical SMILES for 1-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]cyclopropan-1-amine is CN1CCC(n2cc(C3(N)CC3)cn2)CC1.
What is the InChIKey of 1-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]cyclopropan-1-amine?
The InChIKey is CFLFZGFYPJCTHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-15-6-2-11(3-7-15)16-9-10(8-14-16)12(13)4-5-12/h8-9,11H,2-7,13H2,1H3.
What are the key properties of 1-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]cyclopropan-1-amine?
1-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]cyclopropan-1-amine has a molecular weight of 220.32 g/mol, XLogP of 1.10, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]cyclopropan-1-amine is sourced from PubChem (CID 84787606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).