1-(5-amino-1H-pyrazol-4-yl)-6-methylpiperidine-3-carboxamide

C10H17N5O — CID 82235443

IUPAC1-(5-amino-1H-pyrazol-4-yl)-6-methylpiperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1c1cn[nH]c1N
InChIInChI=1S/C10H17N5O/c1-6-2-3-7(10(12)16)5-15(6)8-4-13-14-9(8)11/h4,6-7H,2-3,5H2,1H3,(H2,12,16)(H3,11,13,14)
InChIKeyMHIMQIVSVRCMLT-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.08
Rot. Bonds2

About 1-(5-amino-1H-pyrazol-4-yl)-6-methylpiperidine-3-carboxamide

1-(5-amino-1H-pyrazol-4-yl)-6-methylpiperidine-3-carboxamide (PubChem CID 82235443) has the molecular formula C10H17N5O and a molecular weight of 223.28 g/mol. Its IUPAC name is 1-(5-amino-1H-pyrazol-4-yl)-6-methylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-(5-amino-1H-pyrazol-4-yl)-6-methylpiperidine-3-carboxamide
PubChem CID82235443
Molecular FormulaC10H17N5O
Molecular Weight223.28 g/mol
Exact Mass223.14
IUPAC Name1-(5-amino-1H-pyrazol-4-yl)-6-methylpiperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1c1cn[nH]c1N
InChIInChI=1S/C10H17N5O/c1-6-2-3-7(10(12)16)5-15(6)8-4-13-14-9(8)11/h4,6-7H,2-3,5H2,1H3,(H2,12,16)(H3,11,13,14)
InChIKeyMHIMQIVSVRCMLT-UHFFFAOYSA-N
XLogP0.08
TPSA101.03 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(5-amino-1H-pyrazol-4-yl)-6-methylpiperidine-3-carboxamide?
The IUPAC name of 1-(5-amino-1H-pyrazol-4-yl)-6-methylpiperidine-3-carboxamide (CID 82235443) is 1-(5-amino-1H-pyrazol-4-yl)-6-methylpiperidine-3-carboxamide.
What is the SMILES notation for 1-(5-amino-1H-pyrazol-4-yl)-6-methylpiperidine-3-carboxamide?
The canonical SMILES for 1-(5-amino-1H-pyrazol-4-yl)-6-methylpiperidine-3-carboxamide is CC1CCC(C(N)=O)CN1c1cn[nH]c1N.
What is the InChIKey of 1-(5-amino-1H-pyrazol-4-yl)-6-methylpiperidine-3-carboxamide?
The InChIKey is MHIMQIVSVRCMLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O/c1-6-2-3-7(10(12)16)5-15(6)8-4-13-14-9(8)11/h4,6-7H,2-3,5H2,1H3,(H2,12,16)(H3,11,13,14).
What are the key properties of 1-(5-amino-1H-pyrazol-4-yl)-6-methylpiperidine-3-carboxamide?
1-(5-amino-1H-pyrazol-4-yl)-6-methylpiperidine-3-carboxamide has a molecular weight of 223.28 g/mol, XLogP of 0.08, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-amino-1H-pyrazol-4-yl)-6-methylpiperidine-3-carboxamide is sourced from PubChem (CID 82235443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).