N-(1-cyclopentyl-5-methylpyrazol-4-yl)-5-piperidin-4-yl-1,3-oxazole-4-carboxamide

C18H25N5O2 — CID 167753579

IUPACN-(1-cyclopentyl-5-methylpyrazol-4-yl)-5-piperidin-4-yl-1,3-oxazole-4-carboxamide
SMILESCc1c(NC(=O)c2ncoc2C2CCNCC2)cnn1C1CCCC1
InChIInChI=1S/C18H25N5O2/c1-12-15(10-21-23(12)14-4-2-3-5-14)22-18(24)16-17(25-11-20-16)13-6-8-19-9-7-13/h10-11,13-14,19H,2-9H2,1H3,(H,22,24)
InChIKeyZSXMONPOMXNWEN-UHFFFAOYSA-N
MW343.43 g/mol
LogP3.01
Rot. Bonds4

About N-(1-cyclopentyl-5-methylpyrazol-4-yl)-5-piperidin-4-yl-1,3-oxazole-4-carboxamide

N-(1-cyclopentyl-5-methylpyrazol-4-yl)-5-piperidin-4-yl-1,3-oxazole-4-carboxamide (PubChem CID 167753579) has the molecular formula C18H25N5O2 and a molecular weight of 343.43 g/mol. Its IUPAC name is N-(1-cyclopentyl-5-methylpyrazol-4-yl)-5-piperidin-4-yl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(1-cyclopentyl-5-methylpyrazol-4-yl)-5-piperidin-4-yl-1,3-oxazole-4-carboxamide
PubChem CID167753579
Molecular FormulaC18H25N5O2
Molecular Weight343.43 g/mol
Exact Mass343.20
IUPAC NameN-(1-cyclopentyl-5-methylpyrazol-4-yl)-5-piperidin-4-yl-1,3-oxazole-4-carboxamide
SMILESCc1c(NC(=O)c2ncoc2C2CCNCC2)cnn1C1CCCC1
InChIInChI=1S/C18H25N5O2/c1-12-15(10-21-23(12)14-4-2-3-5-14)22-18(24)16-17(25-11-20-16)13-6-8-19-9-7-13/h10-11,13-14,19H,2-9H2,1H3,(H,22,24)
InChIKeyZSXMONPOMXNWEN-UHFFFAOYSA-N
XLogP3.01
TPSA84.98 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopentyl-5-methylpyrazol-4-yl)-5-piperidin-4-yl-1,3-oxazole-4-carboxamide?
The IUPAC name of N-(1-cyclopentyl-5-methylpyrazol-4-yl)-5-piperidin-4-yl-1,3-oxazole-4-carboxamide (CID 167753579) is N-(1-cyclopentyl-5-methylpyrazol-4-yl)-5-piperidin-4-yl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-(1-cyclopentyl-5-methylpyrazol-4-yl)-5-piperidin-4-yl-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-(1-cyclopentyl-5-methylpyrazol-4-yl)-5-piperidin-4-yl-1,3-oxazole-4-carboxamide is Cc1c(NC(=O)c2ncoc2C2CCNCC2)cnn1C1CCCC1.
What is the InChIKey of N-(1-cyclopentyl-5-methylpyrazol-4-yl)-5-piperidin-4-yl-1,3-oxazole-4-carboxamide?
The InChIKey is ZSXMONPOMXNWEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N5O2/c1-12-15(10-21-23(12)14-4-2-3-5-14)22-18(24)16-17(25-11-20-16)13-6-8-19-9-7-13/h10-11,13-14,19H,2-9H2,1H3,(H,22,24).
What are the key properties of N-(1-cyclopentyl-5-methylpyrazol-4-yl)-5-piperidin-4-yl-1,3-oxazole-4-carboxamide?
N-(1-cyclopentyl-5-methylpyrazol-4-yl)-5-piperidin-4-yl-1,3-oxazole-4-carboxamide has a molecular weight of 343.43 g/mol, XLogP of 3.01, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopentyl-5-methylpyrazol-4-yl)-5-piperidin-4-yl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 167753579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).