N-cyclopentyl-4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide

C20H30N4O3 — CID 53168464

IUPACN-cyclopentyl-4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide
SMILESCc1oc(C2CCN(C(=O)NC3CCCC3)CC2)nc1C(=O)N1CCCC1
InChIInChI=1S/C20H30N4O3/c1-14-17(19(25)23-10-4-5-11-23)22-18(27-14)15-8-12-24(13-9-15)20(26)21-16-6-2-3-7-16/h15-16H,2-13H2,1H3,(H,21,26)
InChIKeyOPIJKCSJMXTBHG-UHFFFAOYSA-N
MW374.49 g/mol
LogP3.05
Rot. Bonds3

About N-cyclopentyl-4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide

N-cyclopentyl-4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide (PubChem CID 53168464) has the molecular formula C20H30N4O3 and a molecular weight of 374.49 g/mol. Its IUPAC name is N-cyclopentyl-4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide
PubChem CID53168464
Molecular FormulaC20H30N4O3
Molecular Weight374.49 g/mol
Exact Mass374.23
IUPAC NameN-cyclopentyl-4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide
SMILESCc1oc(C2CCN(C(=O)NC3CCCC3)CC2)nc1C(=O)N1CCCC1
InChIInChI=1S/C20H30N4O3/c1-14-17(19(25)23-10-4-5-11-23)22-18(27-14)15-8-12-24(13-9-15)20(26)21-16-6-2-3-7-16/h15-16H,2-13H2,1H3,(H,21,26)
InChIKeyOPIJKCSJMXTBHG-UHFFFAOYSA-N
XLogP3.05
TPSA78.68 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.49
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide?
The IUPAC name of N-cyclopentyl-4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide (CID 53168464) is N-cyclopentyl-4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide.
What is the SMILES notation for N-cyclopentyl-4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide?
The canonical SMILES for N-cyclopentyl-4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide is Cc1oc(C2CCN(C(=O)NC3CCCC3)CC2)nc1C(=O)N1CCCC1.
What is the InChIKey of N-cyclopentyl-4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide?
The InChIKey is OPIJKCSJMXTBHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N4O3/c1-14-17(19(25)23-10-4-5-11-23)22-18(27-14)15-8-12-24(13-9-15)20(26)21-16-6-2-3-7-16/h15-16H,2-13H2,1H3,(H,21,26).
What are the key properties of N-cyclopentyl-4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide?
N-cyclopentyl-4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide has a molecular weight of 374.49 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-[5-methyl-4-(pyrrolidine-1-carbonyl)-1,3-oxazol-2-yl]piperidine-1-carboxamide is sourced from PubChem (CID 53168464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).