N-(cyclohexylmethyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-3-carboxamide

C19H27N5O — CID 134796363

IUPACN-(cyclohexylmethyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-3-carboxamide
SMILESO=C(NCC1CCCCC1)C1CCCN(c2ccnc3ccnn23)C1
InChIInChI=1S/C19H27N5O/c25-19(21-13-15-5-2-1-3-6-15)16-7-4-12-23(14-16)18-9-10-20-17-8-11-22-24(17)18/h8-11,15-16H,1-7,12-14H2,(H,21,25)
InChIKeySWSIIWAFCCWXRX-UHFFFAOYSA-N
MW341.46 g/mol
LogP2.64
Rot. Bonds4

About N-(cyclohexylmethyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-3-carboxamide

N-(cyclohexylmethyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-3-carboxamide (PubChem CID 134796363) has the molecular formula C19H27N5O and a molecular weight of 341.46 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-3-carboxamide
PubChem CID134796363
Molecular FormulaC19H27N5O
Molecular Weight341.46 g/mol
Exact Mass341.22
IUPAC NameN-(cyclohexylmethyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-3-carboxamide
SMILESO=C(NCC1CCCCC1)C1CCCN(c2ccnc3ccnn23)C1
InChIInChI=1S/C19H27N5O/c25-19(21-13-15-5-2-1-3-6-15)16-7-4-12-23(14-16)18-9-10-20-17-8-11-22-24(17)18/h8-11,15-16H,1-7,12-14H2,(H,21,25)
InChIKeySWSIIWAFCCWXRX-UHFFFAOYSA-N
XLogP2.64
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.46
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-3-carboxamide?
The IUPAC name of N-(cyclohexylmethyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-3-carboxamide (CID 134796363) is N-(cyclohexylmethyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-3-carboxamide.
What is the SMILES notation for N-(cyclohexylmethyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-3-carboxamide?
The canonical SMILES for N-(cyclohexylmethyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-3-carboxamide is O=C(NCC1CCCCC1)C1CCCN(c2ccnc3ccnn23)C1.
What is the InChIKey of N-(cyclohexylmethyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-3-carboxamide?
The InChIKey is SWSIIWAFCCWXRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O/c25-19(21-13-15-5-2-1-3-6-15)16-7-4-12-23(14-16)18-9-10-20-17-8-11-22-24(17)18/h8-11,15-16H,1-7,12-14H2,(H,21,25).
What are the key properties of N-(cyclohexylmethyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-3-carboxamide?
N-(cyclohexylmethyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-3-carboxamide has a molecular weight of 341.46 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidine-3-carboxamide is sourced from PubChem (CID 134796363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).