1-[1-(cyclopropylmethyl)piperidin-4-yl]pyrazol-4-amine

C12H20N4 — CID 155280275

IUPAC1-[1-(cyclopropylmethyl)piperidin-4-yl]pyrazol-4-amine
SMILESNc1cnn(C2CCN(CC3CC3)CC2)c1
InChIInChI=1S/C12H20N4/c13-11-7-14-16(9-11)12-3-5-15(6-4-12)8-10-1-2-10/h7,9-10,12H,1-6,8,13H2
InChIKeyYPUSMESNGHMMKR-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.51
Rot. Bonds3

About 1-[1-(cyclopropylmethyl)piperidin-4-yl]pyrazol-4-amine

1-[1-(cyclopropylmethyl)piperidin-4-yl]pyrazol-4-amine (PubChem CID 155280275) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 1-[1-(cyclopropylmethyl)piperidin-4-yl]pyrazol-4-amine.

Molecular Properties

Compound Name1-[1-(cyclopropylmethyl)piperidin-4-yl]pyrazol-4-amine
PubChem CID155280275
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name1-[1-(cyclopropylmethyl)piperidin-4-yl]pyrazol-4-amine
SMILESNc1cnn(C2CCN(CC3CC3)CC2)c1
InChIInChI=1S/C12H20N4/c13-11-7-14-16(9-11)12-3-5-15(6-4-12)8-10-1-2-10/h7,9-10,12H,1-6,8,13H2
InChIKeyYPUSMESNGHMMKR-UHFFFAOYSA-N
XLogP1.51
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(cyclopropylmethyl)piperidin-4-yl]pyrazol-4-amine?
The IUPAC name of 1-[1-(cyclopropylmethyl)piperidin-4-yl]pyrazol-4-amine (CID 155280275) is 1-[1-(cyclopropylmethyl)piperidin-4-yl]pyrazol-4-amine.
What is the SMILES notation for 1-[1-(cyclopropylmethyl)piperidin-4-yl]pyrazol-4-amine?
The canonical SMILES for 1-[1-(cyclopropylmethyl)piperidin-4-yl]pyrazol-4-amine is Nc1cnn(C2CCN(CC3CC3)CC2)c1.
What is the InChIKey of 1-[1-(cyclopropylmethyl)piperidin-4-yl]pyrazol-4-amine?
The InChIKey is YPUSMESNGHMMKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c13-11-7-14-16(9-11)12-3-5-15(6-4-12)8-10-1-2-10/h7,9-10,12H,1-6,8,13H2.
What are the key properties of 1-[1-(cyclopropylmethyl)piperidin-4-yl]pyrazol-4-amine?
1-[1-(cyclopropylmethyl)piperidin-4-yl]pyrazol-4-amine has a molecular weight of 220.32 g/mol, XLogP of 1.51, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(cyclopropylmethyl)piperidin-4-yl]pyrazol-4-amine is sourced from PubChem (CID 155280275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).