(3-aminopiperidin-1-yl)-(2-methylpyrazol-3-yl)methanone

C10H16N4O — CID 61297196

IUPAC(3-aminopiperidin-1-yl)-(2-methylpyrazol-3-yl)methanone
SMILESCn1nccc1C(=O)N1CCCC(N)C1
InChIInChI=1S/C10H16N4O/c1-13-9(4-5-12-13)10(15)14-6-2-3-8(11)7-14/h4-5,8H,2-3,6-7,11H2,1H3
InChIKeyRCGMMAPASCCFMC-UHFFFAOYSA-N
MW208.26 g/mol
LogP-0.02
Rot. Bonds1

About (3-aminopiperidin-1-yl)-(2-methylpyrazol-3-yl)methanone

(3-aminopiperidin-1-yl)-(2-methylpyrazol-3-yl)methanone (PubChem CID 61297196) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is (3-aminopiperidin-1-yl)-(2-methylpyrazol-3-yl)methanone.

Molecular Properties

Compound Name(3-aminopiperidin-1-yl)-(2-methylpyrazol-3-yl)methanone
PubChem CID61297196
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name(3-aminopiperidin-1-yl)-(2-methylpyrazol-3-yl)methanone
SMILESCn1nccc1C(=O)N1CCCC(N)C1
InChIInChI=1S/C10H16N4O/c1-13-9(4-5-12-13)10(15)14-6-2-3-8(11)7-14/h4-5,8H,2-3,6-7,11H2,1H3
InChIKeyRCGMMAPASCCFMC-UHFFFAOYSA-N
XLogP-0.02
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3-aminopiperidin-1-yl)-(2-methylpyrazol-3-yl)methanone?
The IUPAC name of (3-aminopiperidin-1-yl)-(2-methylpyrazol-3-yl)methanone (CID 61297196) is (3-aminopiperidin-1-yl)-(2-methylpyrazol-3-yl)methanone.
What is the SMILES notation for (3-aminopiperidin-1-yl)-(2-methylpyrazol-3-yl)methanone?
The canonical SMILES for (3-aminopiperidin-1-yl)-(2-methylpyrazol-3-yl)methanone is Cn1nccc1C(=O)N1CCCC(N)C1.
What is the InChIKey of (3-aminopiperidin-1-yl)-(2-methylpyrazol-3-yl)methanone?
The InChIKey is RCGMMAPASCCFMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-13-9(4-5-12-13)10(15)14-6-2-3-8(11)7-14/h4-5,8H,2-3,6-7,11H2,1H3.
What are the key properties of (3-aminopiperidin-1-yl)-(2-methylpyrazol-3-yl)methanone?
(3-aminopiperidin-1-yl)-(2-methylpyrazol-3-yl)methanone has a molecular weight of 208.26 g/mol, XLogP of -0.02, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminopiperidin-1-yl)-(2-methylpyrazol-3-yl)methanone is sourced from PubChem (CID 61297196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).